5,6-bis(2H-1,3-benzodioxol-5-yl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Chemical Structure Depiction of
5,6-bis(2H-1,3-benzodioxol-5-yl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
5,6-bis(2H-1,3-benzodioxol-5-yl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Compound characteristics
| Compound ID: | 8007-2355 |
| Compound Name: | 5,6-bis(2H-1,3-benzodioxol-5-yl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione |
| Molecular Weight: | 569.57 |
| Molecular Formula: | C35 H23 N O7 |
| Smiles: | C1Oc2ccc(cc2O1)C1=C(c2ccc3c(c2)OCO3)C2(C3C(C(NC3=O)=O)C1(C2=O)c1ccccc1)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4551 |
| logD: | 2.0741 |
| logSw: | -6.0102 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.14 |
| InChI Key: | BLKPYOMSNCGZIT-UHFFFAOYSA-N |