10-[(2-chlorophenyl)methyl]-N-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(2-chlorophenyl)methyl]-N-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(2-chlorophenyl)methyl]-N-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-1465 |
| Compound Name: | 10-[(2-chlorophenyl)methyl]-N-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 499.03 |
| Molecular Formula: | C29 H23 Cl N2 O2 S |
| Smiles: | Cc1ccc(CNC(c2ccc3c(c2)N(Cc2ccccc2[Cl])C(c2ccccc2S3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.7515 |
| logD: | 6.7515 |
| logSw: | -6.0679 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.814 |
| InChI Key: | JIOFQSFACCRJIQ-UHFFFAOYSA-N |