N-[3-(4-benzylpiperidin-1-yl)propyl]-2-chloro-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperidin-1-yl)propyl]-2-chloro-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[3-(4-benzylpiperidin-1-yl)propyl]-2-chloro-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-0664 |
| Compound Name: | N-[3-(4-benzylpiperidin-1-yl)propyl]-2-chloro-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 518.12 |
| Molecular Formula: | C30 H32 Cl N3 O S |
| Smiles: | CC1c2cc(ccc2Sc2ccc(cc2N=1)C(NCCCN1CCC(CC1)Cc1ccccc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.8285 |
| logD: | 4.7939 |
| logSw: | -6.1147 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.466 |
| InChI Key: | SJZNXEJQNVCAHG-UHFFFAOYSA-N |