N-{4-[chloro(difluoro)methoxy]phenyl}-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-{4-[chloro(difluoro)methoxy]phenyl}-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
N-{4-[chloro(difluoro)methoxy]phenyl}-1-methyl-3-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 8018-4790 |
| Compound Name: | N-{4-[chloro(difluoro)methoxy]phenyl}-1-methyl-3-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 346.67 |
| Molecular Formula: | C12 H9 Cl F2 N4 O4 |
| Smiles: | Cn1c(cc(n1)[N+]([O-])=O)C(Nc1ccc(cc1)OC(F)(F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3272 |
| logD: | 2.3238 |
| logSw: | -3.4358 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.188 |
| InChI Key: | MMLHOMLXHAHPFA-UHFFFAOYSA-N |