3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[(4-butoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[(4-butoxyphenyl)methyl]propanamide
3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[(4-butoxyphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | F368-0530 |
| Compound Name: | 3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[(4-butoxyphenyl)methyl]propanamide |
| Molecular Weight: | 497.59 |
| Molecular Formula: | C30 H31 N3 O4 |
| Smiles: | CCCCOc1ccc(CNC(CCc2cn(c3ccccc3)nc2c2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0126 |
| logD: | 6.0126 |
| logSw: | -5.3891 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.604 |
| InChI Key: | VYILMSXEENXBLF-UHFFFAOYSA-N |