ethyl [(3-amino-2-cyano-3-oxo-1-sulfanylprop-1-en-1-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(3-amino-2-cyano-3-oxo-1-sulfanylprop-1-en-1-yl)sulfanyl]acetate
ethyl [(3-amino-2-cyano-3-oxo-1-sulfanylprop-1-en-1-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 8014-3832 |
| Compound Name: | ethyl [(3-amino-2-cyano-3-oxo-1-sulfanylprop-1-en-1-yl)sulfanyl]acetate |
| Molecular Weight: | 246.3 |
| Molecular Formula: | C8 H10 N2 O3 S2 |
| Smiles: | CCOC(CSC(=C(/C#N)C(N)=O)\S)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3078 |
| logD: | -1.8888 |
| logSw: | -0.9344 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.784 |
| InChI Key: | TZWIZDDTNAWSSE-UHFFFAOYSA-N |