N-(2,5-dimethylphenyl)-N-ethyl-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-N-ethyl-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
N-(2,5-dimethylphenyl)-N-ethyl-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea
Compound characteristics
| Compound ID: | E679-0443 |
| Compound Name: | N-(2,5-dimethylphenyl)-N-ethyl-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)urea |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C21 H23 N3 O2 |
| Smiles: | CCN(C(NC1=CN(C)C(c2ccccc12)=O)=O)c1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 3.7192 |
| logD: | 3.7045 |
| logSw: | -3.9142 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.018 |
| InChI Key: | XSXVDPYHBYQRFG-UHFFFAOYSA-N |