N-{1-[(3-methylphenyl)methyl]-1H-pyrazol-3-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{1-[(3-methylphenyl)methyl]-1H-pyrazol-3-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{1-[(3-methylphenyl)methyl]-1H-pyrazol-3-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | 8016-9547 |
| Compound Name: | N-{1-[(3-methylphenyl)methyl]-1H-pyrazol-3-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 335.36 |
| Molecular Formula: | C19 H17 N3 O3 |
| Smiles: | Cc1cccc(Cn2ccc(NC(c3ccc4c(c3)OCO4)=O)n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6246 |
| logD: | 3.6214 |
| logSw: | -3.7612 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.401 |
| InChI Key: | QLSNLHRHBUEVMS-UHFFFAOYSA-N |