AC1LUPHG structure

AC1LUPHG

N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide

Also Known As: AF-399/40684377|N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide|2-(5,6-dimethylthiopheno[3,2-e]pyrimidin-4-ylthio)-N-(3-cyano(4,5,6,7,8-pentah ydrocyclohepta[1,2-d]thiophen-2-yl))acetamide|N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide|N-{3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}-2-({5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide

CAS: 379243-84-2
Molecular Formula C20H20N4OS3
Molecular Weight 428.07993 g/mol
LogP 5.24102
Topological Polar Surface Area 78.67 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 428.07993
Monoisotopic Mass 428.07993
Heavy Atoms 28
Complexity 1093.24

Chemical Identifiers

CAS Number 379243-84-2
SMILES CC1=C(SC2=C1C(=NC=N2)SCC(=O)NC3=C(C4=C(S3)CCCCC4)C#N)C

Product Overview

AC1LUPHG (CAS 379243-84-2), with molecular formula C20H20N4OS3 and molecular weight 428.07993 g/mol. IUPAC: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide.

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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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