N-(2-chloro-4-methylphenyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-(2-chloro-4-methylphenyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | E679-0477 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 341.8 |
| Molecular Formula: | C18 H16 Cl N3 O2 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(NC1=CN(C)C(c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1213 |
| logD: | 2.8987 |
| logSw: | -3.6727 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.756 |
| InChI Key: | ADIXXZRCENEFAG-UHFFFAOYSA-N |