2-bromo-N-[2-(4-chlorophenyl)ethyl]-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
2-bromo-N-[2-(4-chlorophenyl)ethyl]-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
2-bromo-N-[2-(4-chlorophenyl)ethyl]-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-2150 |
| Compound Name: | 2-bromo-N-[2-(4-chlorophenyl)ethyl]-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 499.86 |
| Molecular Formula: | C24 H20 Br Cl N2 O S |
| Smiles: | CCC1c2cc(ccc2Sc2ccc(cc2N=1)C(NCCc1ccc(cc1)[Cl])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.5708 |
| logD: | 6.5706 |
| logSw: | -6.1792 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.486 |
| InChI Key: | IBWJWJGAFYLDHM-UHFFFAOYSA-N |