N-(2-methoxy-5-methylphenyl)-3-methyl-4-nitro-1H-pyrazol-5-amine
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-3-methyl-4-nitro-1H-pyrazol-5-amine
N-(2-methoxy-5-methylphenyl)-3-methyl-4-nitro-1H-pyrazol-5-amine
Compound characteristics
| Compound ID: | 2019-0026 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-3-methyl-4-nitro-1H-pyrazol-5-amine |
| Molecular Weight: | 262.27 |
| Molecular Formula: | C12 H14 N4 O3 |
| Smiles: | Cc1ccc(c(c1)Nc1c(c(C)n[nH]1)[N+]([O-])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2337 |
| logD: | 2.2336 |
| logSw: | -2.6468 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.841 |
| InChI Key: | MVUCVJUCOOSJDF-UHFFFAOYSA-N |