N-[(furan-2-yl)methyl]-N-(3-methylbutyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N-(3-methylbutyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-[(furan-2-yl)methyl]-N-(3-methylbutyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | E679-0577 |
| Compound Name: | N-[(furan-2-yl)methyl]-N-(3-methylbutyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 367.45 |
| Molecular Formula: | C21 H25 N3 O3 |
| Smiles: | CC(C)CCN(Cc1ccco1)C(NC1=CN(C)C(c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2195 |
| logD: | 3.2075 |
| logSw: | -3.6786 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.909 |
| InChI Key: | ZMXJVOIFIAVKMR-UHFFFAOYSA-N |