2-(3,4-dimethylphenyl)-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-(3,4-dimethylphenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanoate
2-(3,4-dimethylphenyl)-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: | 4483-3137 |
| Compound Name: | 2-(3,4-dimethylphenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanoate |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C28 H27 N O5 |
| Smiles: | Cc1ccc(cc1C)C(COC(C(Cc1ccccc1)N1C(C2C3CC(C=C3)C2C1=O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4178 |
| logD: | 4.4178 |
| logSw: | -4.5524 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.366 |
| InChI Key: | UUKIXNLGKBWLGL-UHFFFAOYSA-N |