N-[2-(4-chlorophenyl)ethyl]-10-[(4-chlorophenyl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-10-[(4-chlorophenyl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[2-(4-chlorophenyl)ethyl]-10-[(4-chlorophenyl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
Compound ID: | C530-0975 |
Compound Name: | N-[2-(4-chlorophenyl)ethyl]-10-[(4-chlorophenyl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide |
Molecular Weight: | 565.47 |
Molecular Formula: | C29 H22 Cl2 N2 O4 S |
Smiles: | C(CNC(c1ccc2c(c1)N(Cc1ccc(cc1)[Cl])C(c1ccccc1S2(=O)=O)=O)=O)c1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 5.3577 |
logD: | 5.3577 |
logSw: | -5.8719 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.636 |
InChI Key: | YFJVNIKJZKEQPV-UHFFFAOYSA-N |