N-(3-acetylphenyl)-2-{[4-(4-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-{[4-(4-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-(3-acetylphenyl)-2-{[4-(4-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G681-0809 |
| Compound Name: | N-(3-acetylphenyl)-2-{[4-(4-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 461.97 |
| Molecular Formula: | C25 H20 Cl N3 O2 S |
| Smiles: | CC(c1cccc(c1)NC(CSC1CC(c2ccc(cc2)[Cl])=Nc2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0103 |
| logD: | 5.0094 |
| logSw: | -5.1648 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.166 |
| InChI Key: | QIVGJXVALVTOJW-UHFFFAOYSA-N |