N-{2-[benzyl(ethyl)amino]ethyl}-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-{2-[benzyl(ethyl)amino]ethyl}-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-{2-[benzyl(ethyl)amino]ethyl}-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0396 |
| Compound Name: | N-{2-[benzyl(ethyl)amino]ethyl}-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
| Molecular Weight: | 420.55 |
| Molecular Formula: | C25 H32 N4 O2 |
| Smiles: | CCN(CCNC(NC1=CN(CC(C)C)C(c2ccccc12)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6391 |
| logD: | 1.6256 |
| logSw: | -3.8407 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.588 |
| InChI Key: | BBTJHLCHRWJLDS-UHFFFAOYSA-N |