2-chloro-N-[3-(2-ethylpiperidin-1-yl)propyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
2-chloro-N-[3-(2-ethylpiperidin-1-yl)propyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
2-chloro-N-[3-(2-ethylpiperidin-1-yl)propyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-0647 |
| Compound Name: | 2-chloro-N-[3-(2-ethylpiperidin-1-yl)propyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 456.05 |
| Molecular Formula: | C25 H30 Cl N3 O S |
| Smiles: | CCC1CCCCN1CCCNC(c1ccc2c(c1)N=C(C)c1cc(ccc1S2)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5127 |
| logD: | 2.6457 |
| logSw: | -5.7948 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.549 |
| InChI Key: | MMKYRXDOTIBSLZ-FQEVSTJZSA-N |