N-(5-chloro-2,4-dimethoxyphenyl)-N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-(5-chloro-2,4-dimethoxyphenyl)-N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0128 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
| Molecular Weight: | 443.93 |
| Molecular Formula: | C23 H26 Cl N3 O4 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(N(C)c1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5144 |
| logD: | 4.4005 |
| logSw: | -4.6376 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.585 |
| InChI Key: | RCHOEPVULXKTCR-UHFFFAOYSA-N |