2-{[4-(3-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-[2-(4-chlorophenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{[4-(3-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-[2-(4-chlorophenyl)ethyl]acetamide
2-{[4-(3-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-[2-(4-chlorophenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | C200-6573 |
| Compound Name: | 2-{[4-(3-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-[2-(4-chlorophenyl)ethyl]acetamide |
| Molecular Weight: | 482.43 |
| Molecular Formula: | C25 H21 Cl2 N3 O S |
| Smiles: | C(CNC(CSC1CC(c2cccc(c2)[Cl])=Nc2ccccc2N=1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3624 |
| logD: | 5.3477 |
| logSw: | -5.8474 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.502 |
| InChI Key: | NNHQLOJLIYPXRS-UHFFFAOYSA-N |