N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | E679-0401 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 370.49 |
| Molecular Formula: | C21 H30 N4 O2 |
| Smiles: | CC1CC(C)CN(CCCNC(NC2=CN(C)C(c3ccccc23)=O)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.997 |
| logD: | -0.387 |
| logSw: | -2.7536 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.466 |
| InChI Key: | PMMLZSNEAQUKQH-UHFFFAOYSA-N |