{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}[3-fluoro-4-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}[3-fluoro-4-(trifluoromethyl)phenyl]methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}[3-fluoro-4-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V027-8017 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperidin-1-yl}[3-fluoro-4-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 409.38 |
| Molecular Formula: | C21 H19 F4 N O3 |
| Smiles: | C1CN(CCC1Cc1ccc2c(c1)OCO2)C(c1ccc(c(c1)F)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0358 |
| logD: | 5.0358 |
| logSw: | -5.0129 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.731 |
| InChI Key: | YIGZPXZDNUTOFO-UHFFFAOYSA-N |