N-[2-(4-chlorophenyl)ethyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-[2-(4-chlorophenyl)ethyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0146 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
| Molecular Weight: | 397.9 |
| Molecular Formula: | C22 H24 Cl N3 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(NCCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9426 |
| logD: | 3.8808 |
| logSw: | -4.4815 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.902 |
| InChI Key: | NBORDABFEIFAKS-UHFFFAOYSA-N |