1-(2H-1,3-benzodioxol-5-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
1-(2H-1,3-benzodioxol-5-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-4031 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one |
| Molecular Weight: | 270.29 |
| Molecular Formula: | C15 H14 N2 O3 |
| Smiles: | Cc1c(\C=C/C(c2ccc3c(c2)OCO3)=O)cnn1C |
| Stereo: | ACHIRAL |
| logP: | 2.0761 |
| logD: | 2.0761 |
| logSw: | -2.8025 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.816 |
| InChI Key: | OAXAVSDDEAVXIT-UHFFFAOYSA-N |