2-{[4-(4-fluorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-fluorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
2-{[4-(4-fluorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | G681-0754 |
| Compound Name: | 2-{[4-(4-fluorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C25 H22 F N3 O S |
| Smiles: | C(CNC(CSC1CC(c2ccc(cc2)F)=Nc2ccccc2N=1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1598 |
| logD: | 4.1451 |
| logSw: | -4.4022 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.502 |
| InChI Key: | NMBPNGYIVWBOMV-UHFFFAOYSA-N |