2-{1-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]cyclohexyl}-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-{1-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]cyclohexyl}-2,3-dihydro-1H-isoindol-1-one
2-{1-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]cyclohexyl}-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | D750-0056 |
| Compound Name: | 2-{1-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]cyclohexyl}-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C27 H32 N2 O4 |
| Smiles: | COc1cc2CCN(Cc2cc1OC)C(CC1(CCCCC1)N1Cc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8365 |
| logD: | 3.8365 |
| logSw: | -3.8926 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.263 |
| InChI Key: | YGEQHBFYOULNCE-UHFFFAOYSA-N |