methyl 5-acetamido-4-cyano-3-methylthiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-acetamido-4-cyano-3-methylthiophene-2-carboxylate
methyl 5-acetamido-4-cyano-3-methylthiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8016-5766 |
| Compound Name: | methyl 5-acetamido-4-cyano-3-methylthiophene-2-carboxylate |
| Molecular Weight: | 238.26 |
| Molecular Formula: | C10 H10 N2 O3 S |
| Smiles: | CC(Nc1c(C#N)c(C)c(C(=O)OC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0744 |
| logD: | 0.3243 |
| logSw: | -1.8367 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.525 |
| InChI Key: | YSMFSXGOYVAGAF-UHFFFAOYSA-N |