N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N-phenylurea
Chemical Structure Depiction of
N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N-phenylurea
N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N-phenylurea
Compound characteristics
| Compound ID: | E942-0165 |
| Compound Name: | N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-N-phenylurea |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C21 H23 N3 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(N(C)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4075 |
| logD: | 3.3507 |
| logSw: | -3.8734 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.625 |
| InChI Key: | HVTWYEKOZZOKRI-UHFFFAOYSA-N |