propan-2-yl 2-{[2-(4-chlorophenyl)quinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-{[2-(4-chlorophenyl)quinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 2-{[2-(4-chlorophenyl)quinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-0621 |
| Compound Name: | propan-2-yl 2-{[2-(4-chlorophenyl)quinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 505.04 |
| Molecular Formula: | C28 H25 Cl N2 O3 S |
| Smiles: | CC(C)OC(c1c2CCCCc2sc1NC(c1cc(c2ccc(cc2)[Cl])nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7791 |
| logD: | 5.8398 |
| logSw: | -6.4549 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.536 |
| InChI Key: | NQURXJBEHVGEGP-UHFFFAOYSA-N |