2-(4-ethoxyphenyl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-(4-ethoxyphenyl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3271-0179 |
| Compound Name: | 2-(4-ethoxyphenyl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C28 H25 N O3 |
| Smiles: | CCOc1ccc(cc1)N1C(C2C(C=CC(C2C1=O)c1ccccc1)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.81 |
| logD: | 4.81 |
| logSw: | -4.5777 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.653 |
| InChI Key: | QVHCBIHNSPQTPJ-UHFFFAOYSA-N |