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Also known as: Bms-986115, 1584647-27-7, Notch inhibitor 1, Bms 986115, Lsk1l593uu, (2s,3r)-n'-[(3s)-5-(3-fluorophenyl)-9-methyl-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]-2,3-bis(3,3,3-trifluoropropyl)butanediamide
Molecular Formula
C26H25F7N4O3
Molecular Weight
574.5  g/mol
InChI Key
SRJNRAQUSAVENA-GSHUGGBRSA-N
FDA UNII
LSK1L593UU

Varegacestat
GS/pan-Notch Inhibitor AL102 is an orally bioavailable, gamma secretase (GS) and pan-Notch inhibitor, with potential antineoplastic activity. Upon administration, GS/pan-Notch inhibitor AL102 binds to GS and blocks the proteolytic cleavage and release of the Notch intracellular domain (NICD), which would normally follow ligand binding to the extracellular domain of the Notch receptor. This prevents both the subsequent translocation of NICD to the nucleus to form a transcription factor complex and the expression of Notch-regulated genes. This results in the induction of apoptosis and the inhibition of growth of tumor cells that overexpress Notch. Overexpression of the Notch signaling pathway plays an important role in tumor cell proliferation and survival. The integral membrane protein GS is a multi-subunit protease complex that cleaves single-pass transmembrane proteins, such as Notch receptors, at residues within their transmembrane domains and leads to their activation.
1 2D Structure

Varegacestat

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S,3R)-N'-[(3S)-5-(3-fluorophenyl)-9-methyl-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]-2,3-bis(3,3,3-trifluoropropyl)butanediamide
2.1.2 InChI
InChI=1S/C26H25F7N4O3/c1-13-4-2-7-18-19(13)36-24(40)22(35-20(18)14-5-3-6-15(27)12-14)37-23(39)17(9-11-26(31,32)33)16(21(34)38)8-10-25(28,29)30/h2-7,12,16-17,22H,8-11H2,1H3,(H2,34,38)(H,36,40)(H,37,39)/t16-,17+,22+/m0/s1
2.1.3 InChI Key
SRJNRAQUSAVENA-GSHUGGBRSA-N
2.1.4 Canonical SMILES
CC1=C2C(=CC=C1)C(=NC(C(=O)N2)NC(=O)C(CCC(F)(F)F)C(CCC(F)(F)F)C(=O)N)C3=CC(=CC=C3)F
2.1.5 Isomeric SMILES
CC1=C2C(=CC=C1)C(=N[C@@H](C(=O)N2)NC(=O)[C@H](CCC(F)(F)F)[C@H](CCC(F)(F)F)C(=O)N)C3=CC(=CC=C3)F
2.2 Other Identifiers
2.2.1 UNII
LSK1L593UU
2.3 Synonyms
2.3.1 MeSH Synonyms

1. (2r,3s)-n-((3s)-5-(3-fluorophenyl)-9-methyl-2-oxo-2,3-dihydro-1h-1,4-benzodiazepin-3-yl)-2,3-bis(3,3,3-trifluoropropyl)succinamide

2. Bms-986115

3. Butanediamide, N1-((3s)-5-(3-fluorophenyl)-2,3-dihydro-9-methyl-2-oxo-1h-1,4-benzodiazepin-3-yl)-2,3-bis(3,3,3-trifluoropropyl)-, (2r,3s)-

2.3.2 Depositor-Supplied Synonyms

1. Bms-986115

2. 1584647-27-7

3. Notch Inhibitor 1

4. Bms 986115

5. Lsk1l593uu

6. (2s,3r)-n'-[(3s)-5-(3-fluorophenyl)-9-methyl-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]-2,3-bis(3,3,3-trifluoropropyl)butanediamide

7. Chembl3911164

8. Schembl15608290

9. Bms986115

10. Nsc836050

11. Bms 986115 [who-dd]

12. Db13126

13. Nsc-836050

14. (2r,3s)-n-((3s)-5-(3-fluorophenyl)-9-methyl-2-oxo-2,3-dihydro-1h-1,4-benzodiazepin-3-yl)-2,3-bis(3,3,3-trifluoropropyl)succinamide

15. Hy-12860

16. Cs-0012731

17. P14960

18. Us9273014, 1

19. Q27283163

20. (2r,3s)-n1-((s)-5-(3-fluorophenyl)-9-methyl-2-oxo-2,3-dihydro-1h-benzo[e][1,4]diazepin-3-yl)-2,3-bis(3,3,3-trifluoropropyl)succinamide

21. Butanediamide, N1-((3s)-5-(3-fluorophenyl)-2,3-dihydro-9-methyl-2-oxo-1h-1,4-benzodiazepin-3-yl)-2,3-bis(3,3,3-trifluoropropyl)-, (2r,3s)-

2.4 Create Date
2014-04-07
3 Chemical and Physical Properties
Molecular Weight 574.5 g/mol
Molecular Formula C26H25F7N4O3
XLogP34.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count11
Rotatable Bond Count9
Exact Mass574.18148781 g/mol
Monoisotopic Mass574.18148781 g/mol
Topological Polar Surface Area114 Ų
Heavy Atom Count40
Formal Charge0
Complexity956
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Gamma Secretase Inhibitors and Modulators

Agents that suppress GAMMA-SECRETASE by inhibiting or modulating its activities. Targeted enzymatic activities include its involvement in accumulation of toxic AMYLOID BETA-PEPTIDES (e.g., Aβ42) in ALZHEIMER DISEASE and activation of NOTCH RECEPTOR mediated SIGNAL PATHWAYS in certain cancer types. (See all compounds classified as Gamma Secretase Inhibitors and Modulators.)


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Looking for 1584647-27-7 / BMS-986115 API manufacturers, exporters & distributors?

BMS-986115 manufacturers, exporters & distributors 1

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PharmaCompass offers a list of BMS-986115 API manufacturers, exporters & distributors, which can be sorted by GMP, USDMF, JDMF, KDMF, CEP (COS), WC, Price,and more, enabling you to easily find the right BMS-986115 manufacturer or BMS-986115 supplier for your needs.

Send us enquiries for free, and we will assist you in establishing a direct connection with your preferred BMS-986115 manufacturer or BMS-986115 supplier.

PharmaCompass also assists you with knowing the BMS-986115 API Price utilized in the formulation of products. BMS-986115 API Price is not always fixed or binding as the BMS-986115 Price is obtained through a variety of data sources. The BMS-986115 Price can also vary due to multiple factors, including market conditions, regulatory modifications, or negotiated pricing deals.

API | Excipient name

BMS-986115

Synonyms

1584647-27-7, Notch inhibitor 1, Bms 986115, Lsk1l593uu, (2s,3r)-n'-[(3s)-5-(3-fluorophenyl)-9-methyl-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]-2,3-bis(3,3,3-trifluoropropyl)butanediamide, Chembl3911164

Cas Number

1584647-27-7

Unique Ingredient Identifier (UNII)

LSK1L593UU

About BMS-986115

GS/pan-Notch Inhibitor AL102 is an orally bioavailable, gamma secretase (GS) and pan-Notch inhibitor, with potential antineoplastic activity. Upon administration, GS/pan-Notch inhibitor AL102 binds to GS and blocks the proteolytic cleavage and release of the Notch intracellular domain (NICD), which would normally follow ligand binding to the extracellular domain of the Notch receptor. This prevents both the subsequent translocation of NICD to the nucleus to form a transcription factor complex and the expression of Notch-regulated genes. This results in the induction of apoptosis and the inhibition of growth of tumor cells that overexpress Notch. Overexpression of the Notch signaling pathway plays an important role in tumor cell proliferation and survival. The integral membrane protein GS is a multi-subunit protease complex that cleaves single-pass transmembrane proteins, such as Notch receptors, at residues within their transmembrane domains and leads to their activation.

Varegacestat Manufacturers

A Varegacestat manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Varegacestat, including repackagers and relabelers. The FDA regulates Varegacestat manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Varegacestat API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Varegacestat Suppliers

A Varegacestat supplier is an individual or a company that provides Varegacestat active pharmaceutical ingredient (API) or Varegacestat finished formulations upon request. The Varegacestat suppliers may include Varegacestat API manufacturers, exporters, distributors and traders.

Varegacestat GMP

Varegacestat Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Varegacestat GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Varegacestat GMP manufacturer or Varegacestat GMP API supplier for your needs.

Varegacestat CoA

A Varegacestat CoA (Certificate of Analysis) is a formal document that attests to Varegacestat's compliance with Varegacestat specifications and serves as a tool for batch-level quality control.

Varegacestat CoA mostly includes findings from lab analyses of a specific batch. For each Varegacestat CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Varegacestat may be tested according to a variety of international standards, such as European Pharmacopoeia (Varegacestat EP), Varegacestat JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Varegacestat USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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