N-{2-oxo-1-[1-(3-phenylpropanoyl)piperidin-4-yl]-2-(propylamino)ethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-oxo-1-[1-(3-phenylpropanoyl)piperidin-4-yl]-2-(propylamino)ethyl}-2H-1,3-benzodioxole-5-carboxamide
N-{2-oxo-1-[1-(3-phenylpropanoyl)piperidin-4-yl]-2-(propylamino)ethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
Compound ID: | V016-8891 |
Compound Name: | N-{2-oxo-1-[1-(3-phenylpropanoyl)piperidin-4-yl]-2-(propylamino)ethyl}-2H-1,3-benzodioxole-5-carboxamide |
Molecular Weight: | 479.58 |
Molecular Formula: | C27 H33 N3 O5 |
Smiles: | CCCNC(C(C1CCN(CC1)C(CCc1ccccc1)=O)NC(c1ccc2c(c1)OCO2)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.2651 |
logD: | 3.2651 |
logSw: | -3.5325 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.767 |
InChI Key: | KNZYORPYHPPDHV-VWLOTQADSA-N |