4-[(4-fluorophenyl)sulfanyl]-3-nitro-N-(2-phenylethyl)benzamide
Chemical Structure Depiction of
4-[(4-fluorophenyl)sulfanyl]-3-nitro-N-(2-phenylethyl)benzamide
4-[(4-fluorophenyl)sulfanyl]-3-nitro-N-(2-phenylethyl)benzamide
Compound characteristics
| Compound ID: | K781-2360 |
| Compound Name: | 4-[(4-fluorophenyl)sulfanyl]-3-nitro-N-(2-phenylethyl)benzamide |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C21 H17 F N2 O3 S |
| Smiles: | C(CNC(c1ccc(c(c1)[N+]([O-])=O)Sc1ccc(cc1)F)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0023 |
| logD: | 5.0023 |
| logSw: | -4.9649 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.302 |
| InChI Key: | AIYFYUKKWGSVSI-UHFFFAOYSA-N |