4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide

C13H7ClF5NO2S — CID 2506765

IUPAC4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(F)cc1F)c1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C13H7ClF5NO2S/c14-7-1-4-12(9(5-7)13(17,18)19)23(21,22)20-11-3-2-8(15)6-10(11)16/h1-6,20H
InChIKeyCWDJCVBLMDXTRT-UHFFFAOYSA-N
MW371.71 g/mol
LogP4.44
Rot. Bonds3

About 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide

4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide (PubChem CID 2506765) has the molecular formula C13H7ClF5NO2S and a molecular weight of 371.71 g/mol. Its IUPAC name is 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide
PubChem CID2506765
Molecular FormulaC13H7ClF5NO2S
Molecular Weight371.71 g/mol
Exact Mass370.98
IUPAC Name4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(F)cc1F)c1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C13H7ClF5NO2S/c14-7-1-4-12(9(5-7)13(17,18)19)23(21,22)20-11-3-2-8(15)6-10(11)16/h1-6,20H
InChIKeyCWDJCVBLMDXTRT-UHFFFAOYSA-N
XLogP4.44
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.71
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide 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

4-chloro-N-(2,4-difluorophenyl)-2-fluorobenzenesulfonamide
CID 4968602
4-chloro-2-(trifluoromethyl)-N-[2-(trifluoromethyl)phenyl]benzenesulfonamide
CID 78787079
2,5-dichloro-N-(2,4-difluorophenyl)benzenesulfonamide
CID 3702583
N-(2,4-difluorophenyl)-2,4-difluorobenzenesulfonamide
CID 3312178
4-chloro-2-(trifluoromethyl)benzenesulfonohydrazide
CID 43476927
N-(4-chloro-2-fluorophenyl)-4-fluoro-3-(trifluoromethyl)benzenesulfonamide
CID 60585547
4-fluoro-N-methyl-2-(trifluoromethyl)benzenesulfonamide
CID 165446474
N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 18289032
4-chloro-N-(3,5-dimethoxyphenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 26970163
N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-chloro-2-(trifluoromethyl)benzenesulfonamide
CID 2474429
2-amino-N-(5-chloro-2-fluorophenyl)-4-fluorobenzenesulfonamide
CID 43438207
N-(4-bromo-2-fluorophenyl)-2,4-difluorobenzenesulfonamide
CID 8500760

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide?
The IUPAC name of 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide (CID 2506765) is 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide.
What is the SMILES notation for 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide?
The canonical SMILES for 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide is O=S(=O)(Nc1ccc(F)cc1F)c1ccc(Cl)cc1C(F)(F)F.
What is the InChIKey of 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide?
The InChIKey is CWDJCVBLMDXTRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7ClF5NO2S/c14-7-1-4-12(9(5-7)13(17,18)19)23(21,22)20-11-3-2-8(15)6-10(11)16/h1-6,20H.
What are the key properties of 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide?
4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide has a molecular weight of 371.71 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide is sourced from PubChem (CID 2506765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).