N-{3-[benzyl(propan-2-yl)amino]propyl}-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-{3-[benzyl(propan-2-yl)amino]propyl}-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-{3-[benzyl(propan-2-yl)amino]propyl}-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | C066-4167 |
| Compound Name: | N-{3-[benzyl(propan-2-yl)amino]propyl}-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 406.53 |
| Molecular Formula: | C24 H30 N4 O2 |
| Smiles: | CC(C)N(CCCNC(NC1=CN(C)C(c2ccccc12)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6226 |
| logD: | 0.8376 |
| logSw: | -3.4542 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.214 |
| InChI Key: | ZLLDGMKKDBRZQD-UHFFFAOYSA-N |