(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-chlorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-chlorophenyl)piperazin-1-yl]methanone
(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-chlorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C304-0679 |
| Compound Name: | (2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)[4-(4-chlorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 482.43 |
| Molecular Formula: | C25 H21 Cl2 N3 O S |
| Smiles: | CC1c2cc(ccc2Sc2ccc(cc2N=1)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.1776 |
| logD: | 6.1773 |
| logSw: | -6.068 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.4089 |
| InChI Key: | YJHVLASSXBMLNE-UHFFFAOYSA-N |