AC1LLZJK structure

AC1LLZJK

3,6-diamino-N-(4-bromophenyl)-5-cyano-4-phenylthieno[2,3-b]pyridine-2-carboxamide

Also Known As: ChemDiv1_011606|HMS619P12|3,6-diamino-N-(4-bromophenyl)-5-cyano-4-phenylthieno[2,3-b]pyridine-2-carboxamide|L-Tryptophanamide,5-oxo-L-prolyl-L-histidyl|AG-205/12010122|A1949/0081927|F0291-0056

CAS: 5317-25-9
Molecular Formula C21H14BrN5OS
Molecular Weight 463.01025 g/mol
LogP 5.01418
Topological Polar Surface Area 117.82 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 6
Rotatable Bonds 3
Exact Mass 463.01025
Monoisotopic Mass 463.01025
Heavy Atoms 29
Complexity 1276.9132

Chemical Identifiers

CAS Number 5317-25-9
SMILES C1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)NC4=CC=C(C=C4)Br)N)N)C#N

Product Overview

AC1LLZJK (CAS 5317-25-9), with molecular formula C21H14BrN5OS and molecular weight 463.01025 g/mol. IUPAC: 3,6-diamino-N-(4-bromophenyl)-5-cyano-4-phenylthieno[2,3-b]pyridine-2-carboxamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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