N-(3-methylbutyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-(3-methylbutyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-(3-methylbutyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | E679-0451 |
| Compound Name: | N-(3-methylbutyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 287.36 |
| Molecular Formula: | C16 H21 N3 O2 |
| Smiles: | CC(C)CCNC(NC1=CN(C)C(c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8814 |
| logD: | 1.8582 |
| logSw: | -2.7497 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.889 |
| InChI Key: | FKJBYZQOIRGRTH-UHFFFAOYSA-N |