5-acetyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
Chemical Structure Depiction of
5-acetyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
5-acetyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | P056-0224 |
| Compound Name: | 5-acetyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide |
| Molecular Weight: | 360.5 |
| Molecular Formula: | C18 H20 N2 O2 S2 |
| Smiles: | CC(N1CCc2c(C1)cc(C(NCc1ccc(cc1)SC)=O)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0688 |
| logD: | 3.0688 |
| logSw: | -3.3549 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.72 |
| InChI Key: | YVSVAQFOLLHPNO-UHFFFAOYSA-N |