5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide

C12H8ClF2NO2S — CID 110759379

IUPAC5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1F)c1cc(Cl)ccc1F
InChIInChI=1S/C12H8ClF2NO2S/c13-8-5-6-10(15)12(7-8)19(17,18)16-11-4-2-1-3-9(11)14/h1-7,16H
InChIKeyJKQNBCQRTSKGJG-UHFFFAOYSA-N
MW303.72 g/mol
LogP3.42
Rot. Bonds3

About 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide

5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide (PubChem CID 110759379) has the molecular formula C12H8ClF2NO2S and a molecular weight of 303.72 g/mol. Its IUPAC name is 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide
PubChem CID110759379
Molecular FormulaC12H8ClF2NO2S
Molecular Weight303.72 g/mol
Exact Mass302.99
IUPAC Name5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1F)c1cc(Cl)ccc1F
InChIInChI=1S/C12H8ClF2NO2S/c13-8-5-6-10(15)12(7-8)19(17,18)16-11-4-2-1-3-9(11)14/h1-7,16H
InChIKeyJKQNBCQRTSKGJG-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-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide
CID 81241185
N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 9238961
N-(2-chlorophenyl)-2,5-difluorobenzenesulfonamide
CID 9234601
N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide
CID 43455202
5-chloro-N-(4-chlorophenyl)-2-fluorobenzenesulfonamide
CID 141028077
N-(4-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide
CID 61470421
3,4-dichloro-5-[(2-fluorophenyl)sulfamoyl]benzoic acid
CID 2380504
2-[(2,5-dichlorophenyl)sulfonylamino]-6-fluorobenzoic acid
CID 51116002
2,4-dichloro-N-[2-[(2,4-dichlorophenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 70137943
2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide
CID 43090875
N-(5-chloro-2-methoxyphenyl)-2-fluorobenzenesulfonamide
CID 2696930
2-[(4-chloro-2-fluorophenyl)sulfonylamino]benzamide
CID 4793321

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide?
The IUPAC name of 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide (CID 110759379) is 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide.
What is the SMILES notation for 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide?
The canonical SMILES for 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide is O=S(=O)(Nc1ccccc1F)c1cc(Cl)ccc1F.
What is the InChIKey of 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide?
The InChIKey is JKQNBCQRTSKGJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClF2NO2S/c13-8-5-6-10(15)12(7-8)19(17,18)16-11-4-2-1-3-9(11)14/h1-7,16H.
What are the key properties of 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide?
5-chloro-2-fluoro-N-(2-fluorophenyl)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 5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide is sourced from PubChem (CID 110759379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).