N-(2-ethylphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-(2-ethylphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G681-0111 |
| Compound Name: | N-(2-ethylphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 427.57 |
| Molecular Formula: | C26 H25 N3 O S |
| Smiles: | CCc1ccccc1NC(CSC1CC(c2ccc(C)cc2)=Nc2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5976 |
| logD: | 5.5969 |
| logSw: | -5.4626 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.641 |
| InChI Key: | KEXBSUGULJQGBO-UHFFFAOYSA-N |