N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[(thiophen-2-yl)methyl]urea
Chemical Structure Depiction of
N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[(thiophen-2-yl)methyl]urea
N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[(thiophen-2-yl)methyl]urea
Compound characteristics
| Compound ID: | E942-0142 |
| Compound Name: | N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N'-[(thiophen-2-yl)methyl]urea |
| Molecular Weight: | 355.46 |
| Molecular Formula: | C19 H21 N3 O2 S |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(NCc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1474 |
| logD: | 3.1292 |
| logSw: | -3.6291 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.079 |
| InChI Key: | NDKDJXXQKTYHJD-UHFFFAOYSA-N |