propyl 2-{[2-(5-methylthiophen-2-yl)quinoline-4-carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
propyl 2-{[2-(5-methylthiophen-2-yl)quinoline-4-carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
propyl 2-{[2-(5-methylthiophen-2-yl)quinoline-4-carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-0517 |
| Compound Name: | propyl 2-{[2-(5-methylthiophen-2-yl)quinoline-4-carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 504.67 |
| Molecular Formula: | C28 H28 N2 O3 S2 |
| Smiles: | CCCOC(c1c2CCCCCc2sc1NC(c1cc(c2ccc(C)s2)nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.9416 |
| logD: | 5.9794 |
| logSw: | -5.8741 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.501 |
| InChI Key: | ZVUSYNPCQCSTBP-UHFFFAOYSA-N |