3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid
Chemical Structure Depiction of
3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid
3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid
Compound characteristics
| Compound ID: | 2054-0647 |
| Compound Name: | 3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid |
| Molecular Weight: | 285.3 |
| Molecular Formula: | C16 H15 N O4 |
| Smiles: | C1CC2CC1C1C2C(N(C1=O)c1cccc(c1)C(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5774 |
| logD: | -1.1122 |
| logSw: | -1.7772 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.133 |
| InChI Key: | HUYSBAJEPUUFGG-UHFFFAOYSA-N |