Methyl 2-[3-cyano-4-[3-(trifluoromethyl)phenyl]pyridin-2-yl]sulfanylbenzoate
methyl 2-[[3-cyano-4-[3-(trifluoromethyl)phenyl]-2-pyridinyl]sulfanyl]benzoate
Also Known As: KS-00003G6N|9M-546S|Methyl 2-[3-cyano-4-[3-(trifluoromethyl)phenyl]pyridin-2-yl]sulfanylbenzoate|methyl 2-({3-cyano-4-[3-(trifluoromethyl)phenyl]-2-pyridinyl}sulfanyl)benzenecarboxylate|methyl 2-({3-cyano-4-[3-(trifluoromethyl)phenyl]pyridin-2-yl}sulfanyl)benzoate|methyl2-({3-cyano-4-[3-(trifluoromethyl)phenyl]pyridin-2-yl}sulfanyl)benzoate
| Molecular Formula | C21H13F3N2O2S |
|---|---|
| Molecular Weight | 414.06497 g/mol |
| LogP | 5.57688 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 414.06497 |
| Monoisotopic Mass | 414.06497 |
| Heavy Atoms | 29 |
| Complexity | 1107.5657 |
Chemical Identifiers
| CAS Number | 478245-75-9 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1SC2=NC=CC(=C2C#N)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
Methyl 2-[3-cyano-4-[3-(trifluoromethyl)phenyl]pyridin-2-yl]sulfanylbenzoate (CAS 478245-75-9), with molecular formula C21H13F3N2O2S and molecular weight 414.06497 g/mol. IUPAC: methyl 2-[[3-cyano-4-[3-(trifluoromethyl)phenyl]-2-pyridinyl]sulfanyl]benzoate.
Methyl 2-[3-cyano-4-[3-(trifluoromethyl)phenyl]pyridin-2-yl]sulfanylbenzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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