2-{[4-(4-methoxyphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[4-(4-methoxyphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-phenylacetamide
2-{[4-(4-methoxyphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | L389-0235 |
| Compound Name: | 2-{[4-(4-methoxyphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 443.57 |
| Molecular Formula: | C26 H25 N3 O2 S |
| Smiles: | Cc1cc2c(cc1C)N=C(CC(c1ccc(cc1)OC)=N2)SCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.418 |
| logD: | 5.4121 |
| logSw: | -5.3986 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.883 |
| InChI Key: | KDINVPVVXYDHAR-UHFFFAOYSA-N |