N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide

C12H7ClF3NO2S — CID 9238961

IUPACN-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1cc(Cl)ccc1F)c1cc(F)ccc1F
InChIInChI=1S/C12H7ClF3NO2S/c13-7-1-3-9(15)11(5-7)17-20(18,19)12-6-8(14)2-4-10(12)16/h1-6,17H
InChIKeyPNPMCESWJGMZNC-UHFFFAOYSA-N
MW321.71 g/mol
LogP3.56
Rot. Bonds3

About N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide

N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide (PubChem CID 9238961) has the molecular formula C12H7ClF3NO2S and a molecular weight of 321.71 g/mol. Its IUPAC name is N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
PubChem CID9238961
Molecular FormulaC12H7ClF3NO2S
Molecular Weight321.71 g/mol
Exact Mass320.98
IUPAC NameN-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
SMILESO=S(=O)(Nc1cc(Cl)ccc1F)c1cc(F)ccc1F
InChIInChI=1S/C12H7ClF3NO2S/c13-7-1-3-9(15)11(5-7)17-20(18,19)12-6-8(14)2-4-10(12)16/h1-6,17H
InChIKeyPNPMCESWJGMZNC-UHFFFAOYSA-N
XLogP3.56
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.71
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-(5-chloro-2-fluorophenyl)-4-fluorobenzenesulfonamide
CID 43438207
N-(2-chlorophenyl)-2,5-difluorobenzenesulfonamide
CID 9234601
2,5-difluoro-N-[2-fluoro-5-(trifluoromethyl)phenyl]benzenesulfonamide
CID 22773502
N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide
CID 81241185
N-(5-chloro-2-hydroxyphenyl)-2,4-difluorobenzenesulfonamide
CID 43244390
N-(2-bromo-5-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 103752869
5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide
CID 110759379
2,5-difluoro-N-(2,3,4-trifluorophenyl)benzenesulfonamide
CID 9235627
N-(5-chloro-2-hydroxyphenyl)-5-fluoro-2-methylbenzenesulfonamide
CID 43344384
N-(5-amino-2-fluorophenyl)-2-chloro-5-fluorobenzenesulfonamide
CID 105399424
2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide
CID 43090875
4-bromo-N-(5-chloro-2-fluorophenyl)-2-fluorobenzenesulfonamide
CID 116528139

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide?
The IUPAC name of N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide (CID 9238961) is N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide.
What is the SMILES notation for N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide?
The canonical SMILES for N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide is O=S(=O)(Nc1cc(Cl)ccc1F)c1cc(F)ccc1F.
What is the InChIKey of N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide?
The InChIKey is PNPMCESWJGMZNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClF3NO2S/c13-7-1-3-9(15)11(5-7)17-20(18,19)12-6-8(14)2-4-10(12)16/h1-6,17H.
What are the key properties of N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide?
N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide has a molecular weight of 321.71 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide is sourced from PubChem (CID 9238961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).