6-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione
Chemical Structure Depiction of
6-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione
6-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione
Compound characteristics
| Compound ID: | Y042-7496 |
| Compound Name: | 6-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-9,10-dimethoxy-6,6a-dihydroisoindolo[2,1-a]quinazoline-5,11-dione |
| Molecular Weight: | 483.52 |
| Molecular Formula: | C28 H25 N3 O5 |
| Smiles: | COc1ccc2C3N(CC(N4CCc5ccccc5C4)=O)C(c4ccccc4N3C(c2c1OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8559 |
| logD: | 2.8559 |
| logSw: | -3.4393 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.125 |
| InChI Key: | IEMYMBOTWUPWFX-AREMUKBSSA-N |