2-chloro-N-[(2-chlorophenyl)methyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
2-chloro-N-[(2-chlorophenyl)methyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
2-chloro-N-[(2-chlorophenyl)methyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-0926 |
| Compound Name: | 2-chloro-N-[(2-chlorophenyl)methyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 427.35 |
| Molecular Formula: | C22 H16 Cl2 N2 O S |
| Smiles: | CC1c2cc(ccc2Sc2ccc(cc2N=1)C(NCc1ccccc1[Cl])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.2769 |
| logD: | 6.2769 |
| logSw: | -5.8789 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.914 |
| InChI Key: | RHCKVFDEHSODJE-UHFFFAOYSA-N |