N-[2-(4-chlorophenyl)ethyl]-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-[2-(4-chlorophenyl)ethyl]-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G681-0078 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-[(4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 447.99 |
| Molecular Formula: | C25 H22 Cl N3 O S |
| Smiles: | C(CNC(CSC1CC(c2ccccc2)=Nc2ccccc2N=1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6203 |
| logD: | 4.6057 |
| logSw: | -4.9349 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.502 |
| InChI Key: | OSHWFMJRCQNLBK-UHFFFAOYSA-N |