methyl 2,6-bis(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
Chemical Structure Depiction of
methyl 2,6-bis(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
methyl 2,6-bis(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
Compound characteristics
| Compound ID: | 2054-0259 |
| Compound Name: | methyl 2,6-bis(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)hexanoate |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C25 H28 N2 O6 |
| Smiles: | COC(C(CCCCN1C(C2C3CC(C=C3)C2C1=O)=O)N1C(C2C3CC(C=C3)C2C1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.0135 |
| logD: | 1.0135 |
| logSw: | -1.0178 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.783 |
| InChI Key: | UHMDDADXRUDLBO-UHFFFAOYSA-N |