3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carbonyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carbonyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carbonyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y204-2977 |
| Compound Name: | 3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carbonyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C21 H26 N2 O4 |
| Smiles: | C1CC2C(C(C1O2)C(O)=O)C(N1CCN(CC1)C/C=C/c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6247 |
| logD: | 1.1088 |
| logSw: | -3.7171 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.438 |
| InChI Key: | YGTSBWSWLUWAKN-UHFFFAOYSA-N |