methyl {4-[2-(2H-1,3-benzodioxol-5-yl)ethyl]piperidin-1-yl}(oxo)acetate
Chemical Structure Depiction of
methyl {4-[2-(2H-1,3-benzodioxol-5-yl)ethyl]piperidin-1-yl}(oxo)acetate
methyl {4-[2-(2H-1,3-benzodioxol-5-yl)ethyl]piperidin-1-yl}(oxo)acetate
Compound characteristics
| Compound ID: | V012-5128 |
| Compound Name: | methyl {4-[2-(2H-1,3-benzodioxol-5-yl)ethyl]piperidin-1-yl}(oxo)acetate |
| Molecular Weight: | 319.36 |
| Molecular Formula: | C17 H21 N O5 |
| Smiles: | COC(C(N1CCC(CCc2ccc3c(c2)OCO3)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4912 |
| logD: | 2.4912 |
| logSw: | -2.6401 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.176 |
| InChI Key: | PIXCIXKZOHAGGN-UHFFFAOYSA-N |