2-(2H-1,3-benzodioxol-5-yl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
2-(2H-1,3-benzodioxol-5-yl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8008-8425 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 297.31 |
| Molecular Formula: | C17 H15 N O4 |
| Smiles: | C1CC2C=CC1C1C2C(N(C1=O)c1ccc2c(c1)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.925 |
| logD: | 1.925 |
| logSw: | -2.5085 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.108 |
| InChI Key: | WJJQJFBTEVLVNX-UHFFFAOYSA-N |