1-oxo-2-(pyridin-3-yl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
Chemical Structure Depiction of
1-oxo-2-(pyridin-3-yl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
1-oxo-2-(pyridin-3-yl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
Compound characteristics
| Compound ID: | 8016-6927 |
| Compound Name: | 1-oxo-2-(pyridin-3-yl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid |
| Molecular Weight: | 272.26 |
| Molecular Formula: | C14 H12 N2 O4 |
| Smiles: | C1C23C=CC(C(C2C(N1c1cccnc1)=O)C(O)=O)O3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.22 |
| logD: | -2.0014 |
| logSw: | -0.6267 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.028 |
| InChI Key: | OBRIIHPXQLEJSC-UHFFFAOYSA-N |