N-(3-chloro-4-fluorophenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
N-(3-chloro-4-fluorophenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | 8016-7277 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 354.77 |
| Molecular Formula: | C15 H16 Cl F N4 O3 |
| Smiles: | Cc1c(c(C)n(CCCC(Nc2ccc(c(c2)[Cl])F)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1606 |
| logD: | 2.1167 |
| logSw: | -3.281 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.428 |
| InChI Key: | SVYHFFNXOIIMJK-UHFFFAOYSA-N |