3-[(1-ethyl-1H-pyrazol-3-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-[(1-ethyl-1H-pyrazol-3-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
3-[(1-ethyl-1H-pyrazol-3-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Compound characteristics
Compound ID: | Y504-7865 |
Compound Name: | 3-[(1-ethyl-1H-pyrazol-3-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid |
Molecular Weight: | 275.3 |
Molecular Formula: | C14 H17 N3 O3 |
Smiles: | CCn1ccc(NC(C2C3CC(C=C3)C2C(O)=O)=O)n1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 0.916 |
logD: | -1.4092 |
logSw: | -1.9316 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 67.535 |
InChI Key: | ABXPPRAPQYPCGK-UHFFFAOYSA-N |