2-{[4-(4-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
2-{[4-(4-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | L389-0483 |
| Compound Name: | 2-{[4-(4-chlorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 492.04 |
| Molecular Formula: | C27 H26 Cl N3 O2 S |
| Smiles: | CCOc1ccc(cc1)NC(CSC1CC(c2ccc(cc2)[Cl])=Nc2cc(C)c(C)cc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.591 |
| logD: | 6.5852 |
| logSw: | -6.3155 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.463 |
| InChI Key: | LQJWKRUNXFCKBM-UHFFFAOYSA-N |