3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-(4-methylpiperazin-1-yl)ethyl]propanamide
Chemical Structure Depiction of
3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-(4-methylpiperazin-1-yl)ethyl]propanamide
3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-(4-methylpiperazin-1-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | F368-0505 |
| Compound Name: | 3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-(4-methylpiperazin-1-yl)ethyl]propanamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C26 H31 N5 O3 |
| Smiles: | CN1CCN(CCNC(CCc2cn(c3ccccc3)nc2c2ccc3c(c2)OCO3)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.407 |
| logD: | 1.7396 |
| logSw: | -2.9782 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.487 |
| InChI Key: | XEYFGHJVMKABAZ-UHFFFAOYSA-N |