AC1LX3AJ
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide
Also Known As: AK-968/41024626|N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide|N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-N'-{[2-(3-isopropoxyphenyl)-4-quinolinyl]carbonyl}thiourea|N-(3-CYANO-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL)-N'-{[2-(3-ISOPROPOXYPHENYL)-4-QUINOLYL]CARBONYL}THIOUREA|N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2-[3-(propan-2-yloxy)phenyl]quinoline-4-carboxamide
| Molecular Formula | C29H26N4O2S2 |
|---|---|
| Molecular Weight | 526.1497 g/mol |
| LogP | 6.62778 |
| Topological Polar Surface Area | 87.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 526.1497 |
| Monoisotopic Mass | 526.1497 |
| Heavy Atoms | 37 |
| Complexity | 1551.5406 |
Chemical Identifiers
| CAS Number | 445237-81-0 |
|---|---|
| SMILES | CC(C)OC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=C(C5=C(S4)CCCC5)C#N |
Product Overview
AC1LX3AJ (CAS 445237-81-0), with molecular formula C29H26N4O2S2 and molecular weight 526.1497 g/mol. IUPAC: N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide.
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