2-{[4-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclohexyl]methyl}-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-{[4-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclohexyl]methyl}-2,3-dihydro-1H-isoindol-1-one
2-{[4-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclohexyl]methyl}-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | D757-0184 |
| Compound Name: | 2-{[4-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclohexyl]methyl}-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C27 H32 N2 O4 |
| Smiles: | COc1cc2CCN(Cc2cc1OC)C([C@H]1CC[C@@H](CC1)CN1Cc2ccccc2C1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.9771 |
| logD: | 3.9771 |
| logSw: | -4.2219 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.648 |
| InChI Key: | DIAIEOASDSFWGR-UHFFFAOYSA-N |