N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-methyl-3-nitrobenzamide
N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y205-0661 |
| Compound Name: | N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 288.3 |
| Molecular Formula: | C14 H16 N4 O3 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(NCc1cnn(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6432 |
| logD: | 1.6432 |
| logSw: | -2.1363 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.219 |
| InChI Key: | GVZOIEVDHKWXSJ-UHFFFAOYSA-N |