2-(4-methoxyphenyl)-2-oxoethyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Chemical Structure Depiction of
2-(4-methoxyphenyl)-2-oxoethyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
2-(4-methoxyphenyl)-2-oxoethyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Compound characteristics
| Compound ID: | 2253-0132 |
| Compound Name: | 2-(4-methoxyphenyl)-2-oxoethyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate |
| Molecular Weight: | 431.44 |
| Molecular Formula: | C25 H21 N O6 |
| Smiles: | COc1ccc(cc1)C(COC(c1cccc(c1)N1C(C2C3CC(C=C3)C2C1=O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6676 |
| logD: | 2.6676 |
| logSw: | -2.8765 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.373 |
| InChI Key: | FZAQNMOLWKREQE-UHFFFAOYSA-N |