N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[3-(pyrrolidin-1-yl)propyl]urea
Chemical Structure Depiction of
N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[3-(pyrrolidin-1-yl)propyl]urea
N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[3-(pyrrolidin-1-yl)propyl]urea
Compound characteristics
| Compound ID: | E942-0103 |
| Compound Name: | N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[3-(pyrrolidin-1-yl)propyl]urea |
| Molecular Weight: | 370.49 |
| Molecular Formula: | C21 H30 N4 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(NCCCN1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3525 |
| logD: | -0.5167 |
| logSw: | -3.0729 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.25 |
| InChI Key: | CVNQCYJXGZTRIF-UHFFFAOYSA-N |