N-(4-chloro-2-methoxy-5-methylphenyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-(4-chloro-2-methoxy-5-methylphenyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0089 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
| Molecular Weight: | 413.9 |
| Molecular Formula: | C22 H24 Cl N3 O3 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(Nc1cc(C)c(cc1OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9078 |
| logD: | 4.9061 |
| logSw: | -4.9439 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.671 |
| InChI Key: | WEIYNIFSZZRGCM-UHFFFAOYSA-N |