N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | E679-0482 |
| Compound Name: | N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C24 H28 F N5 O2 |
| Smiles: | CN1C=C(c2ccccc2C1=O)NC(NCCCN1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9316 |
| logD: | 1.4979 |
| logSw: | -2.7804 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.86 |
| InChI Key: | WOQADQMKNIRXLU-UHFFFAOYSA-N |