N-[4-(4-chloro-1H-pyrazol-1-yl)phenyl]-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[4-(4-chloro-1H-pyrazol-1-yl)phenyl]-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
N-[4-(4-chloro-1H-pyrazol-1-yl)phenyl]-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 8018-4792 |
| Compound Name: | N-[4-(4-chloro-1H-pyrazol-1-yl)phenyl]-1-methyl-3-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 346.73 |
| Molecular Formula: | C14 H11 Cl N6 O3 |
| Smiles: | Cn1c(cc(n1)[N+]([O-])=O)C(Nc1ccc(cc1)n1cc(cn1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.8251 |
| logD: | 1.8229 |
| logSw: | -2.7974 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.048 |
| InChI Key: | CBPJQWNULQYUMV-UHFFFAOYSA-N |