N-(2-cyano-4,5-dimethoxyphenyl)-2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(2-cyano-4,5-dimethoxyphenyl)-2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetamide
N-(2-cyano-4,5-dimethoxyphenyl)-2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | 8015-7884 |
| Compound Name: | N-(2-cyano-4,5-dimethoxyphenyl)-2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetamide |
| Molecular Weight: | 510.55 |
| Molecular Formula: | C29 H26 N4 O5 |
| Smiles: | [H]N(C(CN1CCc2ccccc2C1CN1C(c2ccccc2C1=O)=O)=O)c1cc(c(cc1C#N)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1408 |
| logD: | 2.4238 |
| logSw: | -3.4623 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.357 |
| InChI Key: | DSHBRBUIEJVNND-DEOSSOPVSA-N |