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CAS 147008-88-6

Chemistry, 1 End Use API, 6 Related Intermediates

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Also known as: L1bw3q7dkq, (r)-n-demethylfrovatriptan, Frovatriptan related compound a, Frovatriptan related compound a [usp-rs], 147008-88-6, (+)-3-amino-6-carboxamido-1,2,3,4-tetrahydrocarbazole

Molecular Formula

C₁₃H₁₅N₃O

Molecular Weight

229.28 g/mol

InChI Key

PMQBOSGFSARWCB-MRVPVSSYSA-N

FDA UNII

L1BW3Q7DKQ

1 2D Structure

CAS 147008-88-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(6R)-6-amino-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

2.1.2 InChI

InChI=1S/C13H15N3O/c14-8-2-4-12-10(6-8)9-5-7(13(15)17)1-3-11(9)16-12/h1,3,5,8,16H,2,4,6,14H2,(H2,15,17)/t8-/m1/s1

2.1.3 InChI Key

PMQBOSGFSARWCB-MRVPVSSYSA-N

2.1.4 Canonical SMILES

C1CC2=C(CC1N)C3=C(N2)C=CC(=C3)C(=O)N

2.1.5 Isomeric SMILES

C1CC2=C(C[C@@H]1N)C3=C(N2)C=CC(=C3)C(=O)N

2.2 Other Identifiers

2.2.1 UNII

L1BW3Q7DKQ

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. L1bw3q7dkq

2. (r)-n-demethylfrovatriptan

3. Frovatriptan Related Compound A

4. Frovatriptan Related Compound A [usp-rs]

5. 147008-88-6

6. (+)-3-amino-6-carboxamido-1,2,3,4-tetrahydrocarbazole

7. (r)-3-amino-6-carboxamido-1,2,3,4-tetrahydrocarbazole

8. (3r)-3-amino-2,3,4,9-tetrahydro-1h-carbazole-6-carboxamide

9. 1h-carbazole-6-carboxamide, 3-amino-2,3,4,9-tetrahydro-, (3r)-

10. Desmethyl Frovatriptan

11. Unii-l1bw3q7dkq

12. Schembl13152879

13. Zinc3789853

14. Frovatriptan Metabolite, Desmethyl Frovatriptan

2.4 Create Date

2009-05-30

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₁₅N₃O
Molecular Weight	229.28 g/mol
XLogP3	0.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	229.121512110 g/mol
Monoisotopic Mass	229.121512110 g/mol
Topological Polar Surface Area	84.9 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	320
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

619-67-0

End Use API

Stellence Pharmscience Private Limited is a company keenly involved in the business of manufacturing Acti...

Stellence Pharmscience Private Limited is a company keenly involved in the business of manufacturing Active Pharmaceuticals Ingredients (API), High End Intermediates (HEIN) and Contrast Media Products (CMP). In its aspiration to locate a suitable manufacturing location in Bangalore, the company identified and acquired Karnataka Chemsyn Limited (KCL), which was under rehabilitation with the Bureau of Industrial Finance and Reconstruction (BIFR), Govt. of India. With infusion of capital into the company, it has now been rehabilitated and restructured and is a vibrant manufacturing facility located at Jigani, in South Bangalore.

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