ethyl 2-[1-(2-amino-1-cyano-2-oxoethyl)cyclohexyl]-3-hydroxybut-2-enoate
Chemical Structure Depiction of
ethyl 2-[1-(2-amino-1-cyano-2-oxoethyl)cyclohexyl]-3-hydroxybut-2-enoate
ethyl 2-[1-(2-amino-1-cyano-2-oxoethyl)cyclohexyl]-3-hydroxybut-2-enoate
Compound characteristics
| Compound ID: | 8011-0030 |
| Compound Name: | ethyl 2-[1-(2-amino-1-cyano-2-oxoethyl)cyclohexyl]-3-hydroxybut-2-enoate |
| Molecular Weight: | 294.35 |
| Molecular Formula: | C15 H22 N2 O4 |
| Smiles: | CCOC(C(=C(/C)O)/C1(CCCCC1)C(C#N)C(N)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9899 |
| logD: | 0.9895 |
| logSw: | -1.0758 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.176 |
| InChI Key: | TVDHACHZCHYWBM-LLVKDONJSA-N |