AC1LX367
ethyl 4-[[2-(3-propan-2-yloxyphenyl)quinoline-4-carbonyl]carbamothioylamino]benzoate
Also Known As: AK-968/41024571|ethyl 4-[[2-(3-propan-2-yloxyphenyl)quinoline-4-carbonyl]carbamothioylamino]benzoate|ethyl 4-{[({[2-(3-isopropoxyphenyl)-4-quinolinyl]carbonyl}amino)carbothioyl]amino}benzoate|ethyl 4-(3-(2-(3-isopropoxyphenyl)quinoline-4-carbonyl)thioureido)benzoate|ETHYL 4-{[({[2-(3-ISOPROPOXYPHENYL)-4-QUINOLYL]CARBONYL}AMINO)CARBOTHIOYL]AMINO}BENZOATE|ethyl 4-{[({2-[3-(propan-2-yloxy)phenyl]quinolin-4-yl}carbonyl)carbamothioyl]amino}benzoate
| Molecular Formula | C29H27N3O4S |
|---|---|
| Molecular Weight | 513.17224 g/mol |
| LogP | 5.9925 |
| Topological Polar Surface Area | 89.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.17224 |
| Monoisotopic Mass | 513.17224 |
| Heavy Atoms | 37 |
| Complexity | 1451.518 |
Chemical Identifiers
| CAS Number | 445237-41-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OC(C)C |
Product Overview
AC1LX367 (CAS 445237-41-2), with molecular formula C29H27N3O4S and molecular weight 513.17224 g/mol. IUPAC: ethyl 4-[[2-(3-propan-2-yloxyphenyl)quinoline-4-carbonyl]carbamothioylamino]benzoate.
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