N-(2H-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazole-5-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y206-3898 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 245.23 |
| Molecular Formula: | C12 H11 N3 O3 |
| Smiles: | Cn1c(ccn1)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.226 |
| logD: | 1.2244 |
| logSw: | -2.1213 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.095 |
| InChI Key: | PDIGLVOXXHQAHD-UHFFFAOYSA-N |