N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxo-2-(propylamino)ethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxo-2-(propylamino)ethyl}-2H-1,3-benzodioxole-5-carboxamide
N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxo-2-(propylamino)ethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V015-9253 |
| Compound Name: | N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-oxo-2-(propylamino)ethyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 434.56 |
| Molecular Formula: | C21 H30 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCNC(C(C1CCN(CC1)C(NCC)=S)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3413 |
| logD: | 2.3413 |
| logSw: | -2.9536 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.763 |
| InChI Key: | QAOYBKUWWYYJSV-SFHVURJKSA-N |