4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[(4-fluorophenyl)methyl]butanamide
Chemical Structure Depiction of
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[(4-fluorophenyl)methyl]butanamide
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[(4-fluorophenyl)methyl]butanamide
Compound characteristics
| Compound ID: | C163-0299 |
| Compound Name: | 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[(4-fluorophenyl)methyl]butanamide |
| Molecular Weight: | 334.35 |
| Molecular Formula: | C16 H19 F N4 O3 |
| Smiles: | Cc1c(c(C)n(CCCC(NCc2ccc(cc2)F)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.1598 |
| logD: | 1.1598 |
| logSw: | -2.1924 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.75 |
| InChI Key: | UMTASDUNSJROGE-UHFFFAOYSA-N |