3-(2H-1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
3-(2H-1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Compound characteristics
| Compound ID: | 8020-5987 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde |
| Molecular Weight: | 384.39 |
| Molecular Formula: | C20 H20 N2 O6 |
| Smiles: | COc1cc(cc(c1OC)OC)C1CC(c2ccc3c(c2)OCO3)=NN1C=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7853 |
| logD: | 2.7853 |
| logSw: | -3.0853 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.36 |
| InChI Key: | XYKRNAKYHAEBFG-HNNXBMFYSA-N |