N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[1-(thiophen-2-yl)butyl]urea
Chemical Structure Depiction of
N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[1-(thiophen-2-yl)butyl]urea
N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[1-(thiophen-2-yl)butyl]urea
Compound characteristics
| Compound ID: | E942-0336 |
| Compound Name: | N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[1-(thiophen-2-yl)butyl]urea |
| Molecular Weight: | 397.54 |
| Molecular Formula: | C22 H27 N3 O2 S |
| Smiles: | CCCC(c1cccs1)NC(NC1=CN(CC(C)C)C(c2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1116 |
| logD: | 4.1049 |
| logSw: | -4.1394 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.709 |
| InChI Key: | XAGNRUBJGJCPTJ-SFHVURJKSA-N |