2-[(4-fluorophenyl)methyl]-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-[(4-fluorophenyl)methyl]-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8006-2496 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C27 H22 F N O2 |
| Smiles: | C(c1ccc(cc1)F)N1C(C2C(C=CC(C2C1=O)c1ccccc1)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9066 |
| logD: | 4.9066 |
| logSw: | -4.9268 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.1403 |
| InChI Key: | JTDNFYAOHPSUBJ-UHFFFAOYSA-N |