N-(2-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
N-(2-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 2019-0033 |
| Compound Name: | N-(2-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 280.67 |
| Molecular Formula: | C11 H9 Cl N4 O3 |
| Smiles: | Cn1c(C(Nc2ccccc2[Cl])=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7071 |
| logD: | 1.015 |
| logSw: | -2.3567 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.228 |
| InChI Key: | MDPWWVJXWNBLFR-UHFFFAOYSA-N |