2-{[4-(4-fluorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(propan-2-yl)acetamide
Chemical Structure Depiction of
2-{[4-(4-fluorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(propan-2-yl)acetamide
2-{[4-(4-fluorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | L389-0433 |
| Compound Name: | 2-{[4-(4-fluorophenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(propan-2-yl)acetamide |
| Molecular Weight: | 397.51 |
| Molecular Formula: | C22 H24 F N3 O S |
| Smiles: | CC(C)NC(CSC1CC(c2ccc(cc2)F)=Nc2cc(C)c(C)cc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.416 |
| logD: | 4.3083 |
| logSw: | -4.2817 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.907 |
| InChI Key: | IKRBXJZJOJDIKJ-UHFFFAOYSA-N |