N-(3-chlorophenyl)-N-ethyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-(3-chlorophenyl)-N-ethyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-(3-chlorophenyl)-N-ethyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0114 |
| Compound Name: | N-(3-chlorophenyl)-N-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: | CCN(C(NC1=CN(CC(C)C)C(c2ccccc12)=O)=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9369 |
| logD: | 4.7803 |
| logSw: | -4.7643 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.603 |
| InChI Key: | HYCHFHOWAJVGQK-UHFFFAOYSA-N |