2-(4-nitrophenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanoate
Chemical Structure Depiction of
2-(4-nitrophenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanoate
2-(4-nitrophenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanoate
Compound characteristics
| Compound ID: | 4483-3132 |
| Compound Name: | 2-(4-nitrophenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanoate |
| Molecular Weight: | 474.47 |
| Molecular Formula: | C26 H22 N2 O7 |
| Smiles: | C1C2C=CC1C1C2C(N(C(Cc2ccccc2)C(=O)OCC(c2ccc(cc2)[N+]([O-])=O)=O)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1225 |
| logD: | 3.1225 |
| logSw: | -3.5993 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 96.747 |
| InChI Key: | LKVDQJQXVPBMDS-UHFFFAOYSA-N |