N-cyclopentyl-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-cyclopentyl-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-cyclopentyl-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | E679-0499 |
| Compound Name: | N-cyclopentyl-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 285.34 |
| Molecular Formula: | C16 H19 N3 O2 |
| Smiles: | CN1C=C(c2ccccc2C1=O)NC(NC1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5535 |
| logD: | 1.545 |
| logSw: | -2.2852 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.867 |
| InChI Key: | BOPCPSMMDKDETB-UHFFFAOYSA-N |