3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide

C12H8ClF2NO2S — CID 8500608

IUPAC3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1F)c1cccc(Cl)c1
InChIInChI=1S/C12H8ClF2NO2S/c13-8-2-1-3-10(6-8)19(17,18)16-12-7-9(14)4-5-11(12)15/h1-7,16H
InChIKeyUJSRKWXMZGHCCT-UHFFFAOYSA-N
MW303.72 g/mol
LogP3.42
Rot. Bonds3

About 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide

3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide (PubChem CID 8500608) has the molecular formula C12H8ClF2NO2S and a molecular weight of 303.72 g/mol. Its IUPAC name is 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide.

Molecular Properties

Compound Name3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide
PubChem CID8500608
Molecular FormulaC12H8ClF2NO2S
Molecular Weight303.72 g/mol
Exact Mass302.99
IUPAC Name3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1F)c1cccc(Cl)c1
InChIInChI=1S/C12H8ClF2NO2S/c13-8-2-1-3-10(6-8)19(17,18)16-12-7-9(14)4-5-11(12)15/h1-7,16H
InChIKeyUJSRKWXMZGHCCT-UHFFFAOYSA-N
XLogP3.42
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.72
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-difluorophenyl)-3-fluorobenzenesulfonamide
CID 8500597
3-chloro-N-(5-fluoro-2-methoxyphenyl)benzenesulfonamide
CID 110776651
N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide
CID 81258697
3-chloro-N-(2,4-dichlorophenyl)benzenesulfonamide
CID 26952629
2-chloro-N-(2,5-difluorophenyl)pyridine-4-sulfonamide
CID 54895626
N-(2,5-difluorophenyl)naphthalene-2-sulfonamide
CID 22773480
N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 9238961
3-chloro-N-(4-chlorophenyl)benzenesulfonamide
CID 889559
3-chloro-N-[(2,5-difluorophenyl)methyl]benzenesulfonamide
CID 110781006
3-chloro-4-cyano-N-(2,5-difluorophenyl)benzenesulfonamide
CID 115588628
4-amino-N-(2,5-difluorophenyl)benzenesulfonamide
CID 2730891
3-chloro-N-(2-methylphenyl)benzenesulfonamide
CID 26952259

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide?
The IUPAC name of 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide (CID 8500608) is 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide.
What is the SMILES notation for 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide?
The canonical SMILES for 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide is O=S(=O)(Nc1cc(F)ccc1F)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide?
The InChIKey is UJSRKWXMZGHCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClF2NO2S/c13-8-2-1-3-10(6-8)19(17,18)16-12-7-9(14)4-5-11(12)15/h1-7,16H.
What are the key properties of 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide?
3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide has a molecular weight of 303.72 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide is sourced from PubChem (CID 8500608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).