2-(3-nitrophenyl)-2-oxoethyl 2,6-bis(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
Chemical Structure Depiction of
2-(3-nitrophenyl)-2-oxoethyl 2,6-bis(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
2-(3-nitrophenyl)-2-oxoethyl 2,6-bis(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
Compound characteristics
| Compound ID: | 8008-8091 |
| Compound Name: | 2-(3-nitrophenyl)-2-oxoethyl 2,6-bis(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)hexanoate |
| Molecular Weight: | 605.65 |
| Molecular Formula: | C32 H35 N3 O9 |
| Smiles: | C(CCN1C(C2C3CCC(C3)C2C1=O)=O)CC(C(=O)OCC(c1cccc(c1)[N+]([O-])=O)=O)N1C(C2C3CCC(C3)C2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3492 |
| logD: | 2.3492 |
| logSw: | -2.5809 |
| Hydrogen bond acceptors count: | 17 |
| Polar surface area: | 127.095 |
| InChI Key: | KCNYGPBHCOZNPB-UHFFFAOYSA-N |