N-(4-fluorophenyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N-propylurea
Chemical Structure Depiction of
N-(4-fluorophenyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N-propylurea
N-(4-fluorophenyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N-propylurea
Compound characteristics
| Compound ID: | E942-0119 |
| Compound Name: | N-(4-fluorophenyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N-propylurea |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C23 H26 F N3 O2 |
| Smiles: | CCCN(C(NC1=CN(CC(C)C)C(c2ccccc12)=O)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.8409 |
| logD: | 4.8197 |
| logSw: | -4.4077 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.857 |
| InChI Key: | ZOIUFYQEPAMFQH-UHFFFAOYSA-N |