5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide

C6H4BrF3N2O2S — CID 130109962

IUPAC5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide
SMILESNS(=O)(=O)c1ncc(Br)c(C(F)F)c1F
InChIInChI=1S/C6H4BrF3N2O2S/c7-2-1-12-6(15(11,13)14)4(8)3(2)5(9)10/h1,5H,(H2,11,13,14)
InChIKeyUQIFZPMMOWBYDO-UHFFFAOYSA-N
MW305.07 g/mol
LogP1.57
Rot. Bonds2

About 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide

5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 130109962) has the molecular formula C6H4BrF3N2O2S and a molecular weight of 305.07 g/mol. Its IUPAC name is 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound Name5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide
PubChem CID130109962
Molecular FormulaC6H4BrF3N2O2S
Molecular Weight305.07 g/mol
Exact Mass303.91
IUPAC Name5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide
SMILESNS(=O)(=O)c1ncc(Br)c(C(F)F)c1F
InChIInChI=1S/C6H4BrF3N2O2S/c7-2-1-12-6(15(11,13)14)4(8)3(2)5(9)10/h1,5H,(H2,11,13,14)
InChIKeyUQIFZPMMOWBYDO-UHFFFAOYSA-N
XLogP1.57
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.07
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide
CID 118840960
5-chloro-3-(difluoromethyl)-4-fluoropyridine-2-sulfonamide
CID 134674493
4-chloro-3-(difluoromethyl)-5-fluoropyridine-2-sulfonamide
CID 118810599
3-(difluoromethyl)-4-fluoro-5-nitropyridine-2-sulfonamide
CID 133104372
[5-bromo-4-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine
CID 118831229
5-bromo-3-(difluoromethyl)-2-fluoropyridine-4-carbaldehyde
CID 130109713
5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-carboxylic acid
CID 130109738
5-bromo-3-cyano-4-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130109187
5-bromo-3-(difluoromethyl)-4-fluoropyridin-2-amine
CID 119016781
5-chloro-4-(difluoromethyl)-3-fluoropyridine-2-sulfonyl chloride
CID 130072158
6-amino-4-bromo-3-(difluoromethyl)pyridine-2-sulfonamide
CID 130102335
4-amino-6-bromo-5-(difluoromethyl)pyridine-3-sulfonamide
CID 118817717

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide (CID 130109962) is 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide is NS(=O)(=O)c1ncc(Br)c(C(F)F)c1F.
What is the InChIKey of 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is UQIFZPMMOWBYDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrF3N2O2S/c7-2-1-12-6(15(11,13)14)4(8)3(2)5(9)10/h1,5H,(H2,11,13,14).
What are the key properties of 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide?
5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 305.07 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 130109962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).