4-(1',3'-dioxo-1',3',3'a,4',7',7'a-hexahydro-2'H-spiro[cyclopropane-1,8'-[4,7]methanoisoindol]-2'-yl)benzonitrile
Chemical Structure Depiction of
4-(1',3'-dioxo-1',3',3'a,4',7',7'a-hexahydro-2'H-spiro[cyclopropane-1,8'-[4,7]methanoisoindol]-2'-yl)benzonitrile
4-(1',3'-dioxo-1',3',3'a,4',7',7'a-hexahydro-2'H-spiro[cyclopropane-1,8'-[4,7]methanoisoindol]-2'-yl)benzonitrile
Compound characteristics
| Compound ID: | 8007-6797 |
| Compound Name: | 4-(1',3'-dioxo-1',3',3'a,4',7',7'a-hexahydro-2'H-spiro[cyclopropane-1,8'-[4,7]methanoisoindol]-2'-yl)benzonitrile |
| Molecular Weight: | 290.32 |
| Molecular Formula: | C18 H14 N2 O2 |
| Smiles: | C1CC12C1C=CC2C2C1C(N(C2=O)c1ccc(C#N)cc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.0536 |
| logD: | 1.0536 |
| logSw: | -1.8887 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.032 |
| InChI Key: | CRHXIZRVMKNXJI-UHFFFAOYSA-N |