ethyl 2-{2-[(4-methylquinolin-2-yl)sulfanyl]acetamido}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(4-methylquinolin-2-yl)sulfanyl]acetamido}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
ethyl 2-{2-[(4-methylquinolin-2-yl)sulfanyl]acetamido}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5867-3824 |
| Compound Name: | ethyl 2-{2-[(4-methylquinolin-2-yl)sulfanyl]acetamido}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 454.61 |
| Molecular Formula: | C24 H26 N2 O3 S2 |
| Smiles: | CCOC(c1c2CCCCCc2sc1NC(CSc1cc(C)c2ccccc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0231 |
| logD: | 3.9199 |
| logSw: | -5.5532 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.608 |
| InChI Key: | ZIDNTMMIYKPKTA-UHFFFAOYSA-N |