N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
Compound ID: | E942-0351 |
Compound Name: | N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
Molecular Weight: | 398.55 |
Molecular Formula: | C23 H34 N4 O2 |
Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(NCCN1C(C)CCCC1C)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.158 |
logD: | -0.3729 |
logSw: | -3.5784 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 53.439 |
InChI Key: | PVJLPGTYRRBNBC-UHFFFAOYSA-N |