3-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
3-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y205-1870 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid |
| Molecular Weight: | 305.28 |
| Molecular Formula: | C15 H15 N O6 |
| Smiles: | C1CC2C(C(C1O2)C(O)=O)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0163 |
| logD: | 0.5004 |
| logSw: | -3.2352 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.477 |
| InChI Key: | GZIZQJIGTHWOFL-UHFFFAOYSA-N |