2,8-bis(3-chloro-2-methylphenyl)-5-phenyl-3a,4,6,6a,9a,10,10a,10b-octahydro-6,10-ethenoisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
Chemical Structure Depiction of
2,8-bis(3-chloro-2-methylphenyl)-5-phenyl-3a,4,6,6a,9a,10,10a,10b-octahydro-6,10-ethenoisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
2,8-bis(3-chloro-2-methylphenyl)-5-phenyl-3a,4,6,6a,9a,10,10a,10b-octahydro-6,10-ethenoisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
Compound characteristics
| Compound ID: | 8006-5201 |
| Compound Name: | 2,8-bis(3-chloro-2-methylphenyl)-5-phenyl-3a,4,6,6a,9a,10,10a,10b-octahydro-6,10-ethenoisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone |
| Molecular Weight: | 623.54 |
| Molecular Formula: | C36 H28 Cl2 N2 O4 |
| Smiles: | Cc1c(cccc1[Cl])N1C(C2CC(=C3C4C=CC(C3C2C1=O)C1C4C(N(C1=O)c1cccc(c1C)[Cl])=O)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9244 |
| logD: | 5.9244 |
| logSw: | -6.0222 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.681 |
| InChI Key: | XHQNSLPYBFROAP-UHFFFAOYSA-N |