3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1-(2-methoxyethyl)-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Chemical Structure Depiction of
3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1-(2-methoxyethyl)-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1-(2-methoxyethyl)-1,4,5,6,7,7a-hexahydro-2H-indol-2-one
Compound characteristics
| Compound ID: | S579-0448 |
| Compound Name: | 3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1-(2-methoxyethyl)-1,4,5,6,7,7a-hexahydro-2H-indol-2-one |
| Molecular Weight: | 368.48 |
| Molecular Formula: | C22 H28 N2 O3 |
| Smiles: | COCCN1C2CCCCC2=C(CC(N2CCc3ccccc3C2)=O)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7288 |
| logD: | 2.7288 |
| logSw: | -2.733 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.628 |
| InChI Key: | YLOZYGADTLUMOK-HXUWFJFHSA-N |