1-(azepan-1-yl)-3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]propan-1-one
1-(azepan-1-yl)-3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]propan-1-one
Compound characteristics
| Compound ID: | F368-0388 |
| Compound Name: | 1-(azepan-1-yl)-3-[3-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]propan-1-one |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C25 H27 N3 O3 |
| Smiles: | C1CCCN(CC1)C(CCc1cn(c2ccccc2)nc1c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.669 |
| logD: | 4.669 |
| logSw: | -4.5971 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.438 |
| InChI Key: | WGGCGTWYIZVRFX-UHFFFAOYSA-N |