N-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0412 |
| Compound Name: | N-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C28 H35 F N4 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(NCC1CCN(CC1)CCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3733 |
| logD: | 1.8924 |
| logSw: | -4.263 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.771 |
| InChI Key: | CJKYHCBCUAIYEO-UHFFFAOYSA-N |