2-(4-chlorophenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-3-methylbutanoate
Chemical Structure Depiction of
2-(4-chlorophenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-3-methylbutanoate
2-(4-chlorophenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-3-methylbutanoate
Compound characteristics
| Compound ID: | 2054-0701 |
| Compound Name: | 2-(4-chlorophenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-3-methylbutanoate |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C22 H24 Cl N O5 |
| Smiles: | CC(C)C(C(=O)OCC(c1ccc(cc1)[Cl])=O)N1C(C2C3CCC(C3)C2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9794 |
| logD: | 2.9794 |
| logSw: | -3.6778 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.673 |
| InChI Key: | QVYDPTHOKUMAHH-UHFFFAOYSA-N |