2-{4-[(2H-1,3-benzodioxol-5-yl)oxy]phenyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{4-[(2H-1,3-benzodioxol-5-yl)oxy]phenyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
2-{4-[(2H-1,3-benzodioxol-5-yl)oxy]phenyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8018-6692 |
| Compound Name: | 2-{4-[(2H-1,3-benzodioxol-5-yl)oxy]phenyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 375.38 |
| Molecular Formula: | C22 H17 N O5 |
| Smiles: | C1C2C=CC1C1C2C(N(C1=O)c1ccc(cc1)Oc1ccc2c(c1)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.971 |
| logD: | 2.971 |
| logSw: | -3.4156 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.588 |
| InChI Key: | QQPYDLFOXKZNHL-UHFFFAOYSA-N |