N-[(2-chlorophenyl)methyl]-10-[(4-chlorophenyl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-10-[(4-chlorophenyl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[(2-chlorophenyl)methyl]-10-[(4-chlorophenyl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C529-0577 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-10-[(4-chlorophenyl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 535.45 |
| Molecular Formula: | C28 H20 Cl2 N2 O3 S |
| Smiles: | C(c1ccccc1[Cl])NC(c1ccc2c(c1)N(Cc1ccc(cc1)[Cl])C(c1ccccc1S2=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4818 |
| logD: | 5.4818 |
| logSw: | -5.8295 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.198 |
| InChI Key: | UFBGCTATZZERLL-UHFFFAOYSA-N |