4-chloro-N-{1-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-chloro-N-{1-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-nitro-1H-pyrazole-3-carboxamide
4-chloro-N-{1-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-7784 |
| Compound Name: | 4-chloro-N-{1-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 392.77 |
| Molecular Formula: | C16 H14 Cl F N6 O3 |
| Smiles: | Cc1c(c(C)n(Cc2cccc(c2)F)n1)NC(c1c(c([nH]n1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9741 |
| logD: | 1.8879 |
| logSw: | -3.2969 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.062 |
| InChI Key: | HINSVFMSVXDUTK-UHFFFAOYSA-N |