N-(2-{butyl[(furan-2-yl)methyl]amino}ethyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-(2-{butyl[(furan-2-yl)methyl]amino}ethyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-(2-{butyl[(furan-2-yl)methyl]amino}ethyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | C066-4155 |
| Compound Name: | N-(2-{butyl[(furan-2-yl)methyl]amino}ethyl)-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C22 H28 N4 O3 |
| Smiles: | CCCCN(CCNC(NC1=CN(C)C(c2ccccc12)=O)=O)Cc1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 2.4523 |
| logD: | 0.966 |
| logSw: | -3.1164 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.306 |
| InChI Key: | ZRUQYOXHJPDJME-UHFFFAOYSA-N |