N-[2-(difluoromethoxy)-5-methylphenyl]-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[2-(difluoromethoxy)-5-methylphenyl]-4-nitro-1H-pyrazole-3-carboxamide
N-[2-(difluoromethoxy)-5-methylphenyl]-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-3585 |
| Compound Name: | N-[2-(difluoromethoxy)-5-methylphenyl]-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 312.23 |
| Molecular Formula: | C12 H10 F2 N4 O4 |
| Smiles: | Cc1ccc(c(c1)NC(c1c(c[nH]n1)[N+]([O-])=O)=O)OC(F)F |
| Stereo: | ACHIRAL |
| logP: | 1.9534 |
| logD: | 0.9116 |
| logSw: | -2.6663 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.866 |
| InChI Key: | UJLLWNPSEOLEKG-UHFFFAOYSA-N |