N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide

C13H8Cl2F3NO2S — CID 18289032

IUPACN-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)cc1Cl)c1ccccc1C(F)(F)F
InChIInChI=1S/C13H8Cl2F3NO2S/c14-8-5-6-11(10(15)7-8)19-22(20,21)12-4-2-1-3-9(12)13(16,17)18/h1-7,19H
InChIKeyXCVIQWDBCVRCAE-UHFFFAOYSA-N
MW370.18 g/mol
LogP4.81
Rot. Bonds3

About N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide

N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide (PubChem CID 18289032) has the molecular formula C13H8Cl2F3NO2S and a molecular weight of 370.18 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide
PubChem CID18289032
Molecular FormulaC13H8Cl2F3NO2S
Molecular Weight370.18 g/mol
Exact Mass368.96
IUPAC NameN-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)cc1Cl)c1ccccc1C(F)(F)F
InChIInChI=1S/C13H8Cl2F3NO2S/c14-8-5-6-11(10(15)7-8)19-22(20,21)12-4-2-1-3-9(12)13(16,17)18/h1-7,19H
InChIKeyXCVIQWDBCVRCAE-UHFFFAOYSA-N
XLogP4.81
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.18
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chloro-4-methoxyphenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 60597504
4-chloro-2-(trifluoromethyl)-N-[2-(trifluoromethyl)phenyl]benzenesulfonamide
CID 78787079
2-(trifluoromethyl)-N-[4-[[2-(trifluoromethyl)phenyl]sulfonylamino]naphthalen-1-yl]benzenesulfonamide
CID 172801513
2-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 139601759
methyl 2-[(2,4-dichlorophenyl)sulfamoyl]benzoate
CID 54141617
4-chloro-N-(2,4-difluorophenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 2506765
2-[(2,4-dichlorophenyl)sulfamoyl]benzenecarbothioamide
CID 29302580
2,4-dichloro-N-[2-[(2,4-dichlorophenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 70137943
N-(2,4-dimethoxyphenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 26979627
3-chloro-4-fluoro-N-[2-(trifluoromethyl)phenyl]benzenesulfonamide
CID 3809875
5-methyl-2-[[2-(trifluoromethyl)phenyl]sulfonylamino]benzoic acid
CID 51113768
5-chloro-N-(4-morpholin-4-ylsulfonylphenyl)-2-[[2-(trifluoromethyl)phenyl]sulfonylamino]benzamide
CID 22495967

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide (CID 18289032) is N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide is O=S(=O)(Nc1ccc(Cl)cc1Cl)c1ccccc1C(F)(F)F.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide?
The InChIKey is XCVIQWDBCVRCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2F3NO2S/c14-8-5-6-11(10(15)7-8)19-22(20,21)12-4-2-1-3-9(12)13(16,17)18/h1-7,19H.
What are the key properties of N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide?
N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide has a molecular weight of 370.18 g/mol, XLogP of 4.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-(trifluoromethyl)benzenesulfonamide is sourced from PubChem (CID 18289032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).