ethyl 4-{[1-(4-fluorophenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridine-2(1H)-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[1-(4-fluorophenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridine-2(1H)-carbonyl]amino}benzoate
ethyl 4-{[1-(4-fluorophenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridine-2(1H)-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G539-0816 |
| Compound Name: | ethyl 4-{[1-(4-fluorophenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridine-2(1H)-carbonyl]amino}benzoate |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C27 H27 F N2 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCc2c3CCCCc3sc2C1c1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9932 |
| logD: | 6.9932 |
| logSw: | -5.7148 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.375 |
| InChI Key: | VRQVBZGMJFIWND-XMMPIXPASA-N |