N-[2-(azepan-1-yl)ethyl]-5-(4-methylbenzoyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-5-(4-methylbenzoyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
N-[2-(azepan-1-yl)ethyl]-5-(4-methylbenzoyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | P056-0827 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-5-(4-methylbenzoyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide |
| Molecular Weight: | 425.59 |
| Molecular Formula: | C24 H31 N3 O2 S |
| Smiles: | Cc1ccc(cc1)C(N1CCc2c(C1)cc(C(NCCN1CCCCCC1)=O)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7037 |
| logD: | 2.438 |
| logSw: | -3.7635 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.135 |
| InChI Key: | NQZWTDRDNXHWND-UHFFFAOYSA-N |