N-[3-(4-benzylpiperidin-1-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperidin-1-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[3-(4-benzylpiperidin-1-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C791-0072 |
| Compound Name: | N-[3-(4-benzylpiperidin-1-yl)propyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 485.65 |
| Molecular Formula: | C29 H31 N3 O2 S |
| Smiles: | C(CNC(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O)CN1CCC(CC1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3995 |
| logD: | 3.3649 |
| logSw: | -5.7224 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.141 |
| InChI Key: | GGYJWBLPWHUABR-UHFFFAOYSA-N |