2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide

C11H6Cl3FN2O2S — CID 107573404

IUPAC2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide
SMILESO=S(=O)(Nc1cc(Cl)c(F)c(Cl)c1)c1ccnc(Cl)c1
InChIInChI=1S/C11H6Cl3FN2O2S/c12-8-3-6(4-9(13)11(8)15)17-20(18,19)7-1-2-16-10(14)5-7/h1-5,17H
InChIKeyQCZQZYKHBKCLTK-UHFFFAOYSA-N
MW355.61 g/mol
LogP3.98
Rot. Bonds3

About 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide

2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide (PubChem CID 107573404) has the molecular formula C11H6Cl3FN2O2S and a molecular weight of 355.61 g/mol. Its IUPAC name is 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide
PubChem CID107573404
Molecular FormulaC11H6Cl3FN2O2S
Molecular Weight355.61 g/mol
Exact Mass353.92
IUPAC Name2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide
SMILESO=S(=O)(Nc1cc(Cl)c(F)c(Cl)c1)c1ccnc(Cl)c1
InChIInChI=1S/C11H6Cl3FN2O2S/c12-8-3-6(4-9(13)11(8)15)17-20(18,19)7-1-2-16-10(14)5-7/h1-5,17H
InChIKeyQCZQZYKHBKCLTK-UHFFFAOYSA-N
XLogP3.98
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.61
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide
CID 107578079
2-chloro-N-(2,3-difluorophenyl)pyridine-4-sulfonamide
CID 61076644
2-chloro-N-(2,6-difluoro-3-methylphenyl)pyridine-4-sulfonamide
CID 82819125
2-chloro-N-[6-(trifluoromethyl)-3-pyridinyl]pyridine-4-sulfonamide
CID 82795250
2-chloro-N-(3-chloro-4-ethoxyphenyl)pyridine-4-sulfonamide
CID 61041107
2-chloro-N-(2,5-difluorophenyl)pyridine-4-sulfonamide
CID 54895626
2-chloro-N-(5-fluoro-2-pyridinyl)pyridine-4-sulfonamide
CID 65482049
2-chloro-N-(3-methylphenyl)pyridine-4-sulfonamide
CID 54895572
N-(3-chloro-4-fluorophenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 61003566
2-chloro-N-(4-chloro-3-nitrophenyl)pyridine-4-sulfonamide
CID 61051683
2-chloro-N-(4-ethoxyphenyl)pyridine-4-sulfonamide
CID 61003549
N-(3,5-dichloro-4-fluorophenyl)-6-(methylamino)pyridine-3-sulfonamide
CID 107578094

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide?
The IUPAC name of 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide (CID 107573404) is 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide is O=S(=O)(Nc1cc(Cl)c(F)c(Cl)c1)c1ccnc(Cl)c1.
What is the InChIKey of 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide?
The InChIKey is QCZQZYKHBKCLTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Cl3FN2O2S/c12-8-3-6(4-9(13)11(8)15)17-20(18,19)7-1-2-16-10(14)5-7/h1-5,17H.
What are the key properties of 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide?
2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide has a molecular weight of 355.61 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-4-sulfonamide is sourced from PubChem (CID 107573404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).