2-[8-(diphenylmethylidene)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzonitrile
Chemical Structure Depiction of
2-[8-(diphenylmethylidene)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzonitrile
2-[8-(diphenylmethylidene)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzonitrile
Compound characteristics
| Compound ID: | 8009-5170 |
| Compound Name: | 2-[8-(diphenylmethylidene)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzonitrile |
| Molecular Weight: | 428.49 |
| Molecular Formula: | C29 H20 N2 O2 |
| Smiles: | C1=CC2C3C(C1C2=C(c1ccccc1)c1ccccc1)C(N(C3=O)c1ccccc1C#N)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2989 |
| logD: | 4.2989 |
| logSw: | -4.6295 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.937 |
| InChI Key: | OFRQBAXULZRXOQ-UHFFFAOYSA-N |