3-{[3-(benzylcarbamoyl)phenyl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-{[3-(benzylcarbamoyl)phenyl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
3-{[3-(benzylcarbamoyl)phenyl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
Compound ID: | Y207-3814 |
Compound Name: | 3-{[3-(benzylcarbamoyl)phenyl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid |
Molecular Weight: | 394.43 |
Molecular Formula: | C22 H22 N2 O5 |
Smiles: | C1CC2C(C(C1O2)C(O)=O)C(Nc1cccc(c1)C(NCc1ccccc1)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.981 |
logD: | 1.465 |
logSw: | -4.2642 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 84.775 |
InChI Key: | QXSCOJXBBGMLPZ-UHFFFAOYSA-N |