N-cycloheptyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-cycloheptyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-cycloheptyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0057 |
| Compound Name: | N-cycloheptyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
| Molecular Weight: | 355.48 |
| Molecular Formula: | C21 H29 N3 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(NC1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0641 |
| logD: | 4.056 |
| logSw: | -4.2085 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.117 |
| InChI Key: | OERJUCHIBRDMPQ-UHFFFAOYSA-N |