3-[(2-ethylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-[(2-ethylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
3-[(2-ethylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Compound characteristics
Compound ID: | Y204-2146 |
Compound Name: | 3-[(2-ethylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid |
Molecular Weight: | 287.31 |
Molecular Formula: | C16 H17 N O4 |
Smiles: | CCc1ccccc1NC(C1C(C2C=CC1O2)C(O)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.1454 |
logD: | -0.076 |
logSw: | -2.645 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 59.664 |
InChI Key: | CGXAEUHVOGPLNT-UHFFFAOYSA-N |