7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-8-methyl-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-8-methyl-4-phenyl-2H-1-benzopyran-2-one
7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-8-methyl-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-1044 |
| Compound Name: | 7-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-8-methyl-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 425.48 |
| Molecular Formula: | C27 H23 N O4 |
| Smiles: | Cc1c(ccc2C(=CC(=O)Oc12)c1ccccc1)OCC(N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2893 |
| logD: | 4.2893 |
| logSw: | -4.4545 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.427 |
| InChI Key: | PMCUALIKUAETRV-UHFFFAOYSA-N |