N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1-methyl-2-oxo-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1-methyl-2-oxo-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1-methyl-2-oxo-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl)acetamide
Compound characteristics
| Compound ID: | S579-0228 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1-methyl-2-oxo-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl)acetamide |
| Molecular Weight: | 342.39 |
| Molecular Formula: | C19 H22 N2 O4 |
| Smiles: | CN1C2CCCCC2=C(CC(NCc2ccc3c(c2)OCO3)=O)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7858 |
| logD: | 1.7858 |
| logSw: | -2.3437 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.605 |
| InChI Key: | HPCOEXWIJORKGS-OAHLLOKOSA-N |