ethyl 2-acetyl-5-amino-4,6,6-tricyano-3-phenylhex-5-enoate
Chemical Structure Depiction of
ethyl 2-acetyl-5-amino-4,6,6-tricyano-3-phenylhex-5-enoate
ethyl 2-acetyl-5-amino-4,6,6-tricyano-3-phenylhex-5-enoate
Compound characteristics
| Compound ID: | 8020-6153 |
| Compound Name: | ethyl 2-acetyl-5-amino-4,6,6-tricyano-3-phenylhex-5-enoate |
| Molecular Weight: | 350.38 |
| Molecular Formula: | C19 H18 N4 O3 |
| Smiles: | CCOC(C(C(C(C#N)C(=C(C#N)C#N)N)c1ccccc1)C(C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3782 |
| logD: | 0.9335 |
| logSw: | -1.7793 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.129 |
| InChI Key: | KJAJSAQBIXWDHV-UHFFFAOYSA-N |