3-(2H-1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
3-(2H-1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Compound characteristics
Compound ID: | 8020-5986 |
Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde |
Molecular Weight: | 324.33 |
Molecular Formula: | C18 H16 N2 O4 |
Smiles: | COc1ccc(cc1)C1CC(c2ccc3c(c2)OCO3)=NN1C=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.0149 |
logD: | 3.0149 |
logSw: | -3.1199 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 53.926 |
InChI Key: | DWXSAVXAEOULJV-INIZCTEOSA-N |