N-[5,5-dimethyl-3-oxo-2-(3-phenylprop-2-enoyl)cyclohex-1-en-1-yl]alanine
Chemical Structure Depiction of
N-[5,5-dimethyl-3-oxo-2-(3-phenylprop-2-enoyl)cyclohex-1-en-1-yl]alanine
N-[5,5-dimethyl-3-oxo-2-(3-phenylprop-2-enoyl)cyclohex-1-en-1-yl]alanine
Compound characteristics
| Compound ID: | 8013-1239 |
| Compound Name: | N-[5,5-dimethyl-3-oxo-2-(3-phenylprop-2-enoyl)cyclohex-1-en-1-yl]alanine |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C20 H23 N O4 |
| Smiles: | CC(C(O)=O)NC1CC(C)(C)CC(C=1C(/C=C/c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3554 |
| logD: | -0.7832 |
| logSw: | -2.7171 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.54 |
| InChI Key: | DYNXQISBAOMRCL-ZDUSSCGKSA-N |