N-[3-(2-ethylpiperidin-1-yl)propyl]-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(2-ethylpiperidin-1-yl)propyl]-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[3-(2-ethylpiperidin-1-yl)propyl]-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
Compound ID: | C168-0539 |
Compound Name: | N-[3-(2-ethylpiperidin-1-yl)propyl]-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
Molecular Weight: | 457.61 |
Molecular Formula: | C26 H39 N3 O4 |
Smiles: | CCC1CCCCN1CCCNC(C1=CN(CC(C)C)C(c2cc(c(cc12)OC)OC)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3018 |
logD: | 0.4348 |
logSw: | -3.6395 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.782 |
InChI Key: | NCRPSOQXGUPGPE-IBGZPJMESA-N |