10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-N-(1-phenylethyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-N-(1-phenylethyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-N-(1-phenylethyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K786-7138 |
| Compound Name: | 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-N-(1-phenylethyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 517.02 |
| Molecular Formula: | C29 H22 Cl F N2 O2 S |
| Smiles: | CC(c1ccccc1)NC(c1ccc2c(c1)N(Cc1ccc(cc1[Cl])F)C(c1ccccc1S2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8286 |
| logD: | 6.8286 |
| logSw: | -6.1632 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.977 |
| InChI Key: | BBKUXLVBCXXYJU-SFHVURJKSA-N |