(4-benzylpiperidin-1-yl)(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)methanone
Chemical Structure Depiction of
(4-benzylpiperidin-1-yl)(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)methanone
(4-benzylpiperidin-1-yl)(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)methanone
Compound characteristics
| Compound ID: | C304-0705 |
| Compound Name: | (4-benzylpiperidin-1-yl)(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)methanone |
| Molecular Weight: | 461.03 |
| Molecular Formula: | C27 H25 Cl N2 O S |
| Smiles: | CC1c2cc(ccc2Sc2ccc(cc2N=1)C(N1CCC(CC1)Cc1ccccc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.7969 |
| logD: | 6.7965 |
| logSw: | -6.1258 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.877 |
| InChI Key: | XTGASCSYHHSWNX-UHFFFAOYSA-N |