N-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N'-[2-(pyrrolidin-1-yl)ethyl]urea
Chemical Structure Depiction of
N-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N'-[2-(pyrrolidin-1-yl)ethyl]urea
N-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N'-[2-(pyrrolidin-1-yl)ethyl]urea
Compound characteristics
| Compound ID: | E679-0403 |
| Compound Name: | N-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N'-[2-(pyrrolidin-1-yl)ethyl]urea |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | CN1C=C(c2ccccc2C1=O)NC(NCCN1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.67 |
| logD: | -2.7926 |
| logSw: | -2.0834 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.965 |
| InChI Key: | YVXUCDLSOYKSOB-UHFFFAOYSA-N |