methyl 5-benzamido-4-cyano-3-methylthiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-benzamido-4-cyano-3-methylthiophene-2-carboxylate
methyl 5-benzamido-4-cyano-3-methylthiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y204-2538 |
| Compound Name: | methyl 5-benzamido-4-cyano-3-methylthiophene-2-carboxylate |
| Molecular Weight: | 300.33 |
| Molecular Formula: | C15 H12 N2 O3 S |
| Smiles: | Cc1c(C#N)c(NC(c2ccccc2)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.6204 |
| logD: | 0.1927 |
| logSw: | -3.1175 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.354 |
| InChI Key: | YYPKRABQAFIMPY-UHFFFAOYSA-N |