2-{[4-(4-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-phenylacetamide
2-{[4-(4-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | L389-0469 |
| Compound Name: | 2-{[4-(4-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 447.99 |
| Molecular Formula: | C25 H22 Cl N3 O S |
| Smiles: | Cc1cc2c(cc1C)N=C(CC(c1ccc(cc1)[Cl])=N2)SCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0303 |
| logD: | 6.0245 |
| logSw: | -6.1152 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.339 |
| InChI Key: | YXAODKZRAYATBK-UHFFFAOYSA-N |