4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide

C12H7Cl2F2NO2S — CID 4849983

IUPAC4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)cc1F
InChIInChI=1S/C12H7Cl2F2NO2S/c13-7-1-4-12(11(16)5-7)20(18,19)17-8-2-3-10(15)9(14)6-8/h1-6,17H
InChIKeyUTDGKLUTQLMAPW-UHFFFAOYSA-N
MW338.16 g/mol
LogP4.07
Rot. Bonds3

About 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide

4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide (PubChem CID 4849983) has the molecular formula C12H7Cl2F2NO2S and a molecular weight of 338.16 g/mol. Its IUPAC name is 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide
PubChem CID4849983
Molecular FormulaC12H7Cl2F2NO2S
Molecular Weight338.16 g/mol
Exact Mass336.95
IUPAC Name4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)cc1F
InChIInChI=1S/C12H7Cl2F2NO2S/c13-7-1-4-12(11(16)5-7)20(18,19)17-8-2-3-10(15)9(14)6-8/h1-6,17H
InChIKeyUTDGKLUTQLMAPW-UHFFFAOYSA-N
XLogP4.07
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.16
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-4-chloro-N-(3-chloro-4-fluorophenyl)benzenesulfonamide
CID 28938069
N-(3-chloro-4-fluorophenyl)-2,5-dimethylbenzenesulfonamide
CID 793232
N-(3-chloro-4-fluorophenyl)sulfamoyl chloride
CID 84760554
N-(3-chloro-4-fluorophenyl)-3,4-difluorobenzenesulfonamide
CID 8501061
5-chloro-N-(4-chlorophenyl)-2-fluorobenzenesulfonamide
CID 141028077
[3-[(4-chloro-2-fluorophenyl)sulfonylamino]phenyl]urea
CID 36510536
4-chloro-2-fluoro-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)benzenesulfonamide
CID 26978979
N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide
CID 18191076
5-amino-N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzenesulfonamide
CID 80629247
N-(3-chloro-4-fluorophenyl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 54930110
3-amino-N-(3-chloro-4-fluorophenyl)-2,5-dimethylbenzenesulfonamide
CID 79885675
N-tert-butyl-4-[(4-chloro-2-fluorophenyl)sulfonylamino]benzamide
CID 24663149

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide?
The IUPAC name of 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide (CID 4849983) is 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide.
What is the SMILES notation for 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide?
The canonical SMILES for 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide is O=S(=O)(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)cc1F.
What is the InChIKey of 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide?
The InChIKey is UTDGKLUTQLMAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl2F2NO2S/c13-7-1-4-12(11(16)5-7)20(18,19)17-8-2-3-10(15)9(14)6-8/h1-6,17H.
What are the key properties of 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide?
4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide has a molecular weight of 338.16 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide is sourced from PubChem (CID 4849983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).