N-({1-[(4-methylphenyl)methyl]pyrrolidin-3-yl}methyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-({1-[(4-methylphenyl)methyl]pyrrolidin-3-yl}methyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-({1-[(4-methylphenyl)methyl]pyrrolidin-3-yl}methyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0361 |
| Compound Name: | N-({1-[(4-methylphenyl)methyl]pyrrolidin-3-yl}methyl)-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
| Molecular Weight: | 446.59 |
| Molecular Formula: | C27 H34 N4 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(NCC1CCN(C1)Cc1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8433 |
| logD: | 0.2766 |
| logSw: | -4.0012 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.092 |
| InChI Key: | CYCSTOLONAFFHI-JOCHJYFZSA-N |