N-(2-ethylphenyl)-N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-(2-ethylphenyl)-N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-(2-ethylphenyl)-N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
Compound ID: | E942-0106 |
Compound Name: | N-(2-ethylphenyl)-N-methyl-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
Molecular Weight: | 377.49 |
Molecular Formula: | C23 H27 N3 O2 |
Smiles: | CCc1ccccc1N(C)C(NC1=CN(CC(C)C)C(c2ccccc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5939 |
logD: | 4.423 |
logSw: | -4.3275 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.324 |
InChI Key: | NFOPJZZCASLKKK-UHFFFAOYSA-N |