5-Fluoro-3-methyl-benzo[b]thiophene-2-sulfonic acid [4-(2-fluoro-pyridin-4-yl)-2-trifluoromethyl-phenyl]-amide
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Basic information
- Standard SMILES
Cc1c(S(=O)(=O)Nc2ccc(-c3ccnc(F)c3)cc2C(F)(F)F)sc2ccc(F)cc12- InChIKey
KFSZQWMXYLQLJA-UHFFFAOYSA-N- Molecular formula
- C21H13F5N2O2S2
- Average molar mass
- 484.5 g/mol
Names & identifiers
- Preferred name
- 5-Fluoro-3-methyl-benzo[b]thiophene-2-sulfonic acid [4-(2-fluoro-pyridin-4-yl)-2-trifluoromethyl-phenyl]-amide
- IUPAC
- 5-fluoro-N-[4-(2-fluoro-4-pyridinyl)-2-(trifluoromethyl)phenyl]-3-methyl-1-benzothiophene-2-sulfonamide
Names & synonyms
5-Fluoro-3-methyl-benzo[b]thiophene-2-sulfonic acid [4-(2-fluoro-pyridin-4-yl)-2-trifluoromethyl-phenyl]-amideSCHEMBL21126075-Fluoro-3-methyl-benzo[b]thiophene-2-sulfonic acid[4-(2-fluoro-pyridin-4-yl)-2-trifluoromethyl-phenyl]-amide
Database identifiers
- PubChem CID
- 24965626
Properties
Computed structural propertiesFilling in
- XLogP
- 6.1
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 762
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Related reactions
1 records
Compound notes
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