N-(2,2-dimethyloxan-4-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2,2-dimethyloxan-4-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(2,2-dimethyloxan-4-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
Compound ID: | Y041-4422 |
Compound Name: | N-(2,2-dimethyloxan-4-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
Molecular Weight: | 406.48 |
Molecular Formula: | C24 H26 N2 O4 |
Smiles: | CC1(C)CC(CCO1)NC(C1=CN(C(c2ccccc12)=O)c1ccc(cc1)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.0652 |
logD: | 3.0652 |
logSw: | -3.5599 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.636 |
InChI Key: | QCIWFNRQHVCNOW-INIZCTEOSA-N |