ethyl 1-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
ethyl 1-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
Compound characteristics
Compound ID: | V010-8522 |
Compound Name: | ethyl 1-[1-(2H-1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate |
Molecular Weight: | 413.47 |
Molecular Formula: | C22 H27 N3 O5 |
Smiles: | CCCc1cc(C(=O)OCC)nn1C1CCN(CC1)C(c1ccc2c(c1)OCO2)=O |
Stereo: | ACHIRAL |
logP: | 3.2667 |
logD: | 3.2667 |
logSw: | -3.1933 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 67.972 |
InChI Key: | WBOCCUYHBGTFOX-UHFFFAOYSA-N |