2-(3-chloro-4-methylphenyl)-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Chemical Structure Depiction of
2-(3-chloro-4-methylphenyl)-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
2-(3-chloro-4-methylphenyl)-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Compound characteristics
| Compound ID: | 1657-0152 |
| Compound Name: | 2-(3-chloro-4-methylphenyl)-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione |
| Molecular Weight: | 606.12 |
| Molecular Formula: | C40 H28 Cl N O3 |
| Smiles: | Cc1ccc(cc1[Cl])N1C(C2C(C1=O)C1(C(=C(c3ccccc3)C2(C1=O)c1ccccc1)c1ccccc1)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.0045 |
| logD: | 7.9976 |
| logSw: | -6.5316 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.785 |
| InChI Key: | LGDUEQJTCNBWPR-UHFFFAOYSA-N |