N-(2-methoxy-5-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
N-(2-methoxy-5-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 8004-9318 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 290.28 |
| Molecular Formula: | C13 H14 N4 O4 |
| Smiles: | Cc1ccc(c(c1)NC(c1c(cnn1C)[N+]([O-])=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.4933 |
| logD: | 1.2055 |
| logSw: | -2.1932 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.859 |
| InChI Key: | NMXQQJQVLBSPHU-UHFFFAOYSA-N |