N-[(furan-2-yl)methyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N-[(oxolan-2-yl)methyl]urea
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N-[(oxolan-2-yl)methyl]urea
N-[(furan-2-yl)methyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N-[(oxolan-2-yl)methyl]urea
Compound characteristics
| Compound ID: | E679-0569 |
| Compound Name: | N-[(furan-2-yl)methyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N-[(oxolan-2-yl)methyl]urea |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C21 H23 N3 O4 |
| Smiles: | CN1C=C(c2ccccc2C1=O)NC(N(CC1CCCO1)Cc1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7004 |
| logD: | 1.6885 |
| logSw: | -2.554 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.314 |
| InChI Key: | BKRQUDBMTRJWEM-MRXNPFEDSA-N |