ethyl 4-(2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetamido)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetamido)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
ethyl 4-(2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetamido)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | IB02-0909 |
| Compound Name: | ethyl 4-(2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetamido)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate |
| Molecular Weight: | 594.67 |
| Molecular Formula: | C34 H34 N4 O6 |
| Smiles: | CCOC(c1c2c(c(ccc2n(C)c1C)OC)NC(CN1CCc2ccccc2C1CN1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.05 |
| logD: | 3.83 |
| logSw: | -5.2 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.8 |
| InChI Key: | IGZFGQOIFMSBNH-SANMLTNESA-N |