2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide

C11H7Cl2FN2O2S — CID 113251215

IUPAC2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide
SMILESO=S(=O)(Nc1cc(Cl)ccn1)c1ccc(F)cc1Cl
InChIInChI=1S/C11H7Cl2FN2O2S/c12-7-3-4-15-11(5-7)16-19(17,18)10-2-1-8(14)6-9(10)13/h1-6H,(H,15,16)
InChIKeyJUGSUSIYEPPBAM-UHFFFAOYSA-N
MW321.16 g/mol
LogP3.33
Rot. Bonds3

About 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide

2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide (PubChem CID 113251215) has the molecular formula C11H7Cl2FN2O2S and a molecular weight of 321.16 g/mol. Its IUPAC name is 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide
PubChem CID113251215
Molecular FormulaC11H7Cl2FN2O2S
Molecular Weight321.16 g/mol
Exact Mass319.96
IUPAC Name2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide
SMILESO=S(=O)(Nc1cc(Cl)ccn1)c1ccc(F)cc1Cl
InChIInChI=1S/C11H7Cl2FN2O2S/c12-7-3-4-15-11(5-7)16-19(17,18)10-2-1-8(14)6-9(10)13/h1-6H,(H,15,16)
InChIKeyJUGSUSIYEPPBAM-UHFFFAOYSA-N
XLogP3.33
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.16
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-pyridinyl)-4-fluoro-2-nitrobenzenesulfonamide
CID 104821779
2-chloro-N-(4-chloro-2-pyridinyl)-4-nitrobenzenesulfonamide
CID 115687701
2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide
CID 104821040
2-[(2-chloro-5-fluorophenyl)sulfonylamino]pyridine-4-carboxylic acid
CID 105399818
N-(4-chloro-2-pyridinyl)-2-fluoro-5-nitrobenzenesulfonamide
CID 104821758
4-chloro-N-(methylsulfamoyl)pyridin-2-amine
CID 114813660
2-chloro-N-(4-chloro-2-pyridinyl)-5-cyanobenzenesulfonamide
CID 104821746
N-(4-chloro-2-pyridinyl)-3-fluoro-2-nitrobenzenesulfonamide
CID 115687638
N-(4-chloro-2-pyridinyl)sulfamoyl chloride
CID 84760693
N-(4-chloro-2-pyridinyl)-2,4-dimethoxybenzenesulfonamide
CID 104821777
6-[(2-chloro-4-fluorophenyl)sulfonylamino]pyridine-2-carboxylic acid
CID 63643790
2-chloro-N-(4-chloro-2-pyridinyl)pyrimidine-5-sulfonamide
CID 114052244

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide?
The IUPAC name of 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide (CID 113251215) is 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide.
What is the SMILES notation for 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide?
The canonical SMILES for 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide is O=S(=O)(Nc1cc(Cl)ccn1)c1ccc(F)cc1Cl.
What is the InChIKey of 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide?
The InChIKey is JUGSUSIYEPPBAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2FN2O2S/c12-7-3-4-15-11(5-7)16-19(17,18)10-2-1-8(14)6-9(10)13/h1-6H,(H,15,16).
What are the key properties of 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide?
2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide has a molecular weight of 321.16 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide is sourced from PubChem (CID 113251215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).