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Chemistry

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Also known as: Ctp-543 phosphate, C-21543 phosphate, D8-ruxolitinib phosphate, D8- ruxolitinib phosphate, 8vj43s4lcm, Deuruxolitinib phosphate [usan]
Molecular Formula
C17H21N6O4P
Molecular Weight
412.4  g/mol
InChI Key
JFMWPOCYMYGEDM-NTVOUFPTSA-N
FDA UNII
8VJ43S4LCM

Deuruxolitinib phosphate
1 2D Structure

Deuruxolitinib phosphate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(3R)-3-(2,2,3,3,4,4,5,5-octadeuteriocyclopentyl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propanenitrile;phosphoric acid
2.1.2 InChI
InChI=1S/C17H18N6.H3O4P/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16;1-5(2,3)4/h6,8-12,15H,1-5H2,(H,19,20,21);(H3,1,2,3,4)/t15-;/m1./s1/i1D2,2D2,3D2,4D2;
2.1.3 InChI Key
JFMWPOCYMYGEDM-NTVOUFPTSA-N
2.1.4 Canonical SMILES
C1CCC(C1)C(CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3.OP(=O)(O)O
2.1.5 Isomeric SMILES
[2H]C1(C(C(C(C1([2H])[2H])([2H])[2H])([2H])[2H])[C@@H](CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3)[2H].OP(=O)(O)O
2.2 Other Identifiers
2.2.1 UNII
8VJ43S4LCM
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Ctp-543 Phosphate

2. C-21543 Phosphate

3. D8-ruxolitinib Phosphate

4. D8- Ruxolitinib Phosphate

5. 8vj43s4lcm

6. Deuruxolitinib Phosphate [usan]

7. 2147706-60-1

8. Deuruxolitinib Phosphate (usan)

9. (3r)-3-(2,2,3,3,4,4,5,5-d8)cyclopentyl-3-(4-(7h-pyrrolo(2,3-d)pyrimidin-4-yl)-1h-pyrazol-1-yl)propanenitrile Phosphate (1:1)

10. Leqselvi (tn)

11. Unii-8vj43s4lcm

12. Chembl4594382

13. D11867

14. 1h-pyrazole-1-propanenitrile, .beta.-(cyclopentyl-2,2,3,3,4,4,5,5-d8)-4-(7h-pyrrolo(2,3-d)pyrimidin-4-yl)-, (.beta.r)-, Phosphate

15. 1h-pyrazole-1-propanenitrile, Beta-(cyclopentyl-2,2,3,3,4,4,5,5-d8)-4-(7hpyrrolo(2,3-d)pyrimidin-4-yl)-, (betar)-, Phosphate (1:1)

2.4 Create Date
2020-08-20
3 Chemical and Physical Properties
Molecular Weight 412.4 g/mol
Molecular Formula C17H21N6O4P
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area161
Heavy Atom Count28
Formal Charge0
Complexity503
Isotope Atom Count8
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

API SUPPLIERS

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01

MSN Laboratories

India

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

ASC 2024
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Listed Suppliers

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ASC 2024
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Deuruxolitinib

About the Company : Founded in 2003, Hyderabad-based MSN Labs is one of the fastest-growing research-based pharmaceutical company in India. Boasting a diverse product portfolio, with multiple products...

Founded in 2003, Hyderabad-based MSN Labs is one of the fastest-growing research-based pharmaceutical company in India. Boasting a diverse product portfolio, with multiple products in the market and in the pipeline, MSN has 6 API (including Oncology) and one finished dosage facilities (one more for Oncology is being built) and an integrated R&D Center for Contract Research And Manufacturing Services (CRAMS) located in Hyderabad. MSN has won the trust of more than 250 customers across 65 countries around the globe covering the US, Europe, Latin America, Middle-East, Asia Pacific, Africa and CIS markets. Our product basket offers 100 APIs
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Drugs in Development

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Details:

Leqselvi (deuruxolitinib phosphate) is a JAK1/JAK2 inhibitor, small molecule drug candidate, which is being evaluated for the treatment of severe alopecia areata in adults.


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: Leqselvi

Study Phase: ApprovedProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable July 26, 2024

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01

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : Leqselvi (deuruxolitinib phosphate) is a JAK1/JAK2 inhibitor, small molecule drug candidate, which is being evaluated for the treatment of severe alopecia areata in adults.

Brand Name : Leqselvi

Molecule Type : Small molecule

Upfront Cash : Not Applicable

July 26, 2024

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Details:

Under the license agreement, Aclaris granted Sun Pharma exclusive rights under certain patents for the use of deuruxolitinib, Sun Pharma’s JAK inhibitor, or other isotopic forms of ruxolitinib, to treat alopecia areata (AA) or androgenetic alopecia (AGA).


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP-543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Sun Pharmaceutical Industries Limited

Deal Size: Undisclosed Upfront Cash: $15.0 million

Deal Type: Licensing Agreement December 05, 2023

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02

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : Under the license agreement, Aclaris granted Sun Pharma exclusive rights under certain patents for the use of deuruxolitinib, Sun Pharma’s JAK inhibitor, or other isotopic forms of ruxolitinib, to treat alopecia areata (AA) or androgenetic alopecia (AG...

Brand Name : CTP-543

Molecule Type : Small molecule

Upfront Cash : $15.0 million

December 05, 2023

blank

Details:

CTP-543 (deuruxolitinib) is an investigational oral selective inhibitor of Janus kinases JAK1 and JAK2, which is investigated for the treatmet of moderate to severe alopecia areata.


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP-543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable October 06, 2023

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03

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : CTP-543 (deuruxolitinib) is an investigational oral selective inhibitor of Janus kinases JAK1 and JAK2, which is investigated for the treatmet of moderate to severe alopecia areata.

Brand Name : CTP-543

Molecule Type : Small molecule

Upfront Cash : Not Applicable

October 06, 2023

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Details:

Acquisition adds CTP‑543 (deuruxolitinib), a Potential Best-in-Class oral inhibitor of Janus kinases JAK1 and JAK2 for the treatment of Alopecia Areata, an autoimmune dermatological disease which is in late-stage development, to Sun Pharma's Global Dermatology Portfolio.


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP-543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Sun Pharmaceutical Industries Limited

Deal Size: $576.0 million Upfront Cash: $576.0 million

Deal Type: Acquisition March 06, 2023

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04

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : Acquisition adds CTP‑543 (deuruxolitinib), a Potential Best-in-Class oral inhibitor of Janus kinases JAK1 and JAK2 for the treatment of Alopecia Areata, an autoimmune dermatological disease which is in late-stage development, to Sun Pharma's Global Der...

Brand Name : CTP-543

Molecule Type : Small molecule

Upfront Cash : $576.0 million

March 06, 2023

blank

Details:

CTP-543 (deuruxolitinib) is an investigational oral selective inhibitor of Janus kinases JAK1 and JAK2. It has received breakthrough Therapy Designation from FDA for the Treatment of Alopecia Areata


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP-543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable February 15, 2023

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05

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : CTP-543 (deuruxolitinib) is an investigational oral selective inhibitor of Janus kinases JAK1 and JAK2. It has received breakthrough Therapy Designation from FDA for the Treatment of Alopecia Areata

Brand Name : CTP-543

Molecule Type : Small molecule

Upfront Cash : Not Applicable

February 15, 2023

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Details:

Concert has an extensive patent portfolio, including its lead product candidate CTP‑543 (deuruxolitinib) – an oral inhibitor of Janus kinases JAK1 and JAK2 for the treatment of Alopecia Areata, an autoimmune dermatological disease – which is in late-stage development.


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP‑543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Sun Pharmaceutical Industries Limited

Deal Size: $576.0 million Upfront Cash: $576.0 million

Deal Type: Acquisition January 19, 2023

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06

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : Concert has an extensive patent portfolio, including its lead product candidate CTP‑543 (deuruxolitinib) – an oral inhibitor of Janus kinases JAK1 and JAK2 for the treatment of Alopecia Areata, an autoimmune dermatological disease – which is in lat...

Brand Name : CTP‑543

Molecule Type : Small molecule

Upfront Cash : $576.0 million

January 19, 2023

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Details:

Deuruxolitinib (CTP-543) is an investigational oral selective inhibitor of Janus kinases JAK1 and JAK2. Deuruxolitinib was generally well-tolerated in THRIVE-AA1, consistent with its other Phase 2 and Phase 3 studies.


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP-543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable November 21, 2022

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07

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : Deuruxolitinib (CTP-543) is an investigational oral selective inhibitor of Janus kinases JAK1 and JAK2. Deuruxolitinib was generally well-tolerated in THRIVE-AA1, consistent with its other Phase 2 and Phase 3 studies.

Brand Name : CTP-543

Molecule Type : Small molecule

Upfront Cash : Not Applicable

November 21, 2022

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Details:

The presentation highlights THRIVE-AA1 study results evaluating Concert’s oral investigational medicine CTP-543 (deuruxolitinib) in adult patients with moderate to severe alopecia areata, an autoimmune disorder that results in patchy or complete scalp hair loss.


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP-543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable September 10, 2022

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08

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : The presentation highlights THRIVE-AA1 study results evaluating Concert’s oral investigational medicine CTP-543 (deuruxolitinib) in adult patients with moderate to severe alopecia areata, an autoimmune disorder that results in patchy or complete scalp ...

Brand Name : CTP-543

Molecule Type : Small molecule

Upfront Cash : Not Applicable

September 10, 2022

blank

Details:

CTP-543 (deuruxolitinib) is an investigational oral selective inhibitor of Janus kinases JAK1 and JAK2, for the treatment of adult patients with moderate to severe alopecia areata.


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP-543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable August 22, 2022

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09

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : CTP-543 (deuruxolitinib) is an investigational oral selective inhibitor of Janus kinases JAK1 and JAK2, for the treatment of adult patients with moderate to severe alopecia areata.

Brand Name : CTP-543

Molecule Type : Small molecule

Upfront Cash : Not Applicable

August 22, 2022

blank

Details:

The publication reports clinically meaningful and statistically significant scalp hair regrowth after 24 weeks of treatment with CTP-543 (deuruxolitinib) in both the 8 mg twice-daily and 12 mg twice-daily dose groups in patients with alopecia areata.


Lead Product(s): Deuruxolitinib phosphate

Therapeutic Area: Dermatology Brand Name: CTP-543

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable June 07, 2022

blank

10

ASC 2024
Not Confirmed
ASC 2024
Not Confirmed

Details : The publication reports clinically meaningful and statistically significant scalp hair regrowth after 24 weeks of treatment with CTP-543 (deuruxolitinib) in both the 8 mg twice-daily and 12 mg twice-daily dose groups in patients with alopecia areata.

Brand Name : CTP-543

Molecule Type : Small molecule

Upfront Cash : Not Applicable

June 07, 2022

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