N-(4-fluoro-2-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(4-fluoro-2-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
N-(4-fluoro-2-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-1711 |
| Compound Name: | N-(4-fluoro-2-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 278.24 |
| Molecular Formula: | C12 H11 F N4 O3 |
| Smiles: | Cc1cc(ccc1NC(c1c(cnn1C)[N+]([O-])=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 1.6753 |
| logD: | 0.8593 |
| logSw: | -2.2206 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.228 |
| InChI Key: | VVTHOSIEFNPFMW-UHFFFAOYSA-N |