N-(2-cyanophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(2-cyanophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
N-(2-cyanophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 8009-5321 |
| Compound Name: | N-(2-cyanophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 271.23 |
| Molecular Formula: | C12 H9 N5 O3 |
| Smiles: | Cn1c(C(Nc2ccccc2C#N)=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.0735 |
| logD: | -0.3852 |
| logSw: | -2.2147 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.284 |
| InChI Key: | NZZGWGZZMPOXPY-UHFFFAOYSA-N |