N-(3-chloro-4-fluorophenyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-(3-chloro-4-fluorophenyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | E679-0308 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 345.76 |
| Molecular Formula: | C17 H13 Cl F N3 O2 |
| Smiles: | CN1C=C(c2ccccc2C1=O)NC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1267 |
| logD: | 2.8872 |
| logSw: | -3.7779 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.453 |
| InChI Key: | PFWILKMAFOWURN-UHFFFAOYSA-N |