2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide

C19H15F2NO3S — CID 2494967

IUPAC2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide
SMILESCc1ccc(Oc2ccc(NS(=O)(=O)c3ccc(F)cc3F)cc2)cc1
InChIInChI=1S/C19H15F2NO3S/c1-13-2-7-16(8-3-13)25-17-9-5-15(6-10-17)22-26(23,24)19-11-4-14(20)12-18(19)21/h2-12,22H,1H3
InChIKeyLGIJINWDAOIBDL-UHFFFAOYSA-N
MW375.40 g/mol
LogP4.87
Rot. Bonds5

About 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide

2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide (PubChem CID 2494967) has the molecular formula C19H15F2NO3S and a molecular weight of 375.40 g/mol. Its IUPAC name is 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide
PubChem CID2494967
Molecular FormulaC19H15F2NO3S
Molecular Weight375.40 g/mol
Exact Mass375.07
IUPAC Name2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide
SMILESCc1ccc(Oc2ccc(NS(=O)(=O)c3ccc(F)cc3F)cc2)cc1
InChIInChI=1S/C19H15F2NO3S/c1-13-2-7-16(8-3-13)25-17-9-5-15(6-10-17)22-26(23,24)19-11-4-14(20)12-18(19)21/h2-12,22H,1H3
InChIKeyLGIJINWDAOIBDL-UHFFFAOYSA-N
XLogP4.87
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.40
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]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

2,4-difluoro-N-[4-(methanesulfonamido)phenyl]benzenesulfonamide
CID 31073462
N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-2,4-difluorobenzenesulfonamide
CID 2488296
4-bromo-2,5-difluoro-N-(4-methylphenyl)benzenesulfonamide
CID 2809184
N-[4-(chloromethyl)phenyl]-2,4-difluorobenzenesulfonamide
CID 65030660
N-[4-(diethylamino)phenyl]-2,4-difluorobenzenesulfonamide
CID 3377300
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2,4-difluorobenzenesulfonamide
CID 22205497
N-[4-(3,4-dimethylphenoxy)phenyl]-4-methylbenzenesulfonamide
CID 1377807
2,4,5-trimethyl-N-[4-[4-[(2,4,5-trimethylphenyl)sulfonylamino]phenoxy]phenyl]benzenesulfonamide
CID 25046641
2,4-difluoro-N-(2,3,4,5,6-pentafluorophenyl)benzenesulfonamide
CID 22774544
N-[4-(2-bromoethyl)phenyl]-2,4-difluorobenzenesulfonamide
CID 114296387
2,4-difluoro-N-(4-fluoro-2-methylphenyl)benzenesulfonamide
CID 5020613
N-(3-amino-4-ethylphenyl)-2,4-difluorobenzenesulfonamide
CID 43551083

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide?
The IUPAC name of 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide (CID 2494967) is 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide.
What is the SMILES notation for 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide?
The canonical SMILES for 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide is Cc1ccc(Oc2ccc(NS(=O)(=O)c3ccc(F)cc3F)cc2)cc1.
What is the InChIKey of 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide?
The InChIKey is LGIJINWDAOIBDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2NO3S/c1-13-2-7-16(8-3-13)25-17-9-5-15(6-10-17)22-26(23,24)19-11-4-14(20)12-18(19)21/h2-12,22H,1H3.
What are the key properties of 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide?
2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide has a molecular weight of 375.40 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-[4-(4-methylphenoxy)phenyl]benzenesulfonamide is sourced from PubChem (CID 2494967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).