N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | C590-0120 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 351.36 |
| Molecular Formula: | C19 H17 N3 O4 |
| Smiles: | COc1ccc(cc1)c1cc(C(NCc2ccc3c(c2)OCO3)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 3.353 |
| logD: | 3.3528 |
| logSw: | -3.5093 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.801 |
| InChI Key: | QYGABUAXVDWPSU-UHFFFAOYSA-N |