N-(3-ethylphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-ethylphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-(3-ethylphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G681-0112 |
| Compound Name: | N-(3-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: | CCc1cccc(c1)NC(CSC1CC(c2ccc(C)cc2)=Nc2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8885 |
| logD: | 5.8878 |
| logSw: | -5.4863 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.339 |
| InChI Key: | MAQGCOXTYFKVEZ-UHFFFAOYSA-N |