2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide

C12H8Cl2FNO3S — CID 103088374

IUPAC2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cccc(O)c1)c1ccc(Cl)c(F)c1Cl
InChIInChI=1S/C12H8Cl2FNO3S/c13-9-4-5-10(11(14)12(9)15)20(18,19)16-7-2-1-3-8(17)6-7/h1-6,16-17H
InChIKeyZTFGLMVOULCYMM-UHFFFAOYSA-N
MW336.17 g/mol
LogP3.64
Rot. Bonds3

About 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide

2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide (PubChem CID 103088374) has the molecular formula C12H8Cl2FNO3S and a molecular weight of 336.17 g/mol. Its IUPAC name is 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide
PubChem CID103088374
Molecular FormulaC12H8Cl2FNO3S
Molecular Weight336.17 g/mol
Exact Mass334.96
IUPAC Name2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cccc(O)c1)c1ccc(Cl)c(F)c1Cl
InChIInChI=1S/C12H8Cl2FNO3S/c13-9-4-5-10(11(14)12(9)15)20(18,19)16-7-2-1-3-8(17)6-7/h1-6,16-17H
InChIKeyZTFGLMVOULCYMM-UHFFFAOYSA-N
XLogP3.64
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.17
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)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-dichloro-N-[3-(chloromethyl)phenyl]-3-fluorobenzenesulfonamide
CID 103089625
2,4,5-trichloro-N-(3-hydroxyphenyl)benzenesulfonamide
CID 39845466
N-(3-bromo-4-chlorophenyl)-2,4-dichloro-3-fluorobenzenesulfonamide
CID 103088310
4-bromo-2-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide
CID 116527650
2,4-dichloro-3-fluoro-N-(3-hydroxy-2-pyridinyl)benzenesulfonamide
CID 103088425
2,4-dichloro-3-fluoro-N-(2-hydroxy-4-methylphenyl)benzenesulfonamide
CID 103088377
N-(6-bromo-3-pyridinyl)-2,4-dichloro-3-fluorobenzenesulfonamide
CID 103223782
N-(3-hydroxyphenyl)sulfamoyl chloride
CID 84760564
N-(2-bromo-5-fluorophenyl)-2,4-dichloro-3-fluorobenzenesulfonamide
CID 107640855
4-amino-2-cyano-N-(3-hydroxyphenyl)benzenesulfonamide
CID 61166320
N-(3-hydroxyphenyl)-4-iodobenzenesulfonamide
CID 4254070
4-fluoro-N-(3-hydroxyphenyl)-2,6-dimethylbenzenesulfonamide
CID 107326957

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide?
The IUPAC name of 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide (CID 103088374) is 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide.
What is the SMILES notation for 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide?
The canonical SMILES for 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide is O=S(=O)(Nc1cccc(O)c1)c1ccc(Cl)c(F)c1Cl.
What is the InChIKey of 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide?
The InChIKey is ZTFGLMVOULCYMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2FNO3S/c13-9-4-5-10(11(14)12(9)15)20(18,19)16-7-2-1-3-8(17)6-7/h1-6,16-17H.
What are the key properties of 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide?
2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide has a molecular weight of 336.17 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide is sourced from PubChem (CID 103088374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).