N-(3,5-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-(3,5-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G681-0473 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 443.57 |
| Molecular Formula: | C26 H25 N3 O2 S |
| Smiles: | Cc1cc(C)cc(c1)NC(CSC1CC(c2ccc(cc2)OC)=Nc2ccccc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.35 |
| logD: | 5.3493 |
| logSw: | -5.3418 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.883 |
| InChI Key: | WDLSXOXTQPXYAB-UHFFFAOYSA-N |