methyl 5-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}thiophene-2-carboxylate
methyl 5-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8020-5668 |
| Compound Name: | methyl 5-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}thiophene-2-carboxylate |
| Molecular Weight: | 318.41 |
| Molecular Formula: | C15 H14 N2 O2 S2 |
| Smiles: | Cc1cc(C)nc(c1C#N)SCc1ccc(C(=O)OC)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.8546 |
| logD: | 3.8546 |
| logSw: | -4.0901 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.769 |
| InChI Key: | KTPFYZOLXHIKPO-UHFFFAOYSA-N |