2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide

C12H9F2NO3S — CID 43090875

IUPAC2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1O)c1cc(F)ccc1F
InChIInChI=1S/C12H9F2NO3S/c13-8-5-6-9(14)12(7-8)19(17,18)15-10-3-1-2-4-11(10)16/h1-7,15-16H
InChIKeyFOVSALTZVZMQNK-UHFFFAOYSA-N
MW285.27 g/mol
LogP2.47
Rot. Bonds3

About 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide

2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide (PubChem CID 43090875) has the molecular formula C12H9F2NO3S and a molecular weight of 285.27 g/mol. Its IUPAC name is 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide
PubChem CID43090875
Molecular FormulaC12H9F2NO3S
Molecular Weight285.27 g/mol
Exact Mass285.03
IUPAC Name2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1O)c1cc(F)ccc1F
InChIInChI=1S/C12H9F2NO3S/c13-8-5-6-9(14)12(7-8)19(17,18)15-10-3-1-2-4-11(10)16/h1-7,15-16H
InChIKeyFOVSALTZVZMQNK-UHFFFAOYSA-N
XLogP2.47
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.27
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-chlorophenyl)-2,5-difluorobenzenesulfonamide
CID 9234601
2,5-difluoro-N-[2-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 29099021
2-[(2,5-difluorophenyl)sulfonylamino]benzenecarbothioamide
CID 43236177
2,5-difluoro-N-[2-(trifluoromethoxy)phenyl]benzenesulfonamide
CID 27301700
N-(2-bromo-5-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 103752869
N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 9238961
2,5-difluoro-N-(2,3,4-trifluorophenyl)benzenesulfonamide
CID 9235627
N-[2-(1-bromoethyl)phenyl]-2,5-difluorobenzenesulfonamide
CID 114294218
2,3-difluoro-N-(5-fluoro-2-hydroxyphenyl)benzenesulfonamide
CID 71975700
N-(5-chloro-2-hydroxyphenyl)-2,4-difluorobenzenesulfonamide
CID 43244390
N-(5-chloro-2-hydroxyphenyl)-5-fluoro-2-methylbenzenesulfonamide
CID 43344384
5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide
CID 110759379

Frequently Asked Questions

What is the IUPAC name of 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide?
The IUPAC name of 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide (CID 43090875) is 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide.
What is the SMILES notation for 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide?
The canonical SMILES for 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide is O=S(=O)(Nc1ccccc1O)c1cc(F)ccc1F.
What is the InChIKey of 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide?
The InChIKey is FOVSALTZVZMQNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2NO3S/c13-8-5-6-9(14)12(7-8)19(17,18)15-10-3-1-2-4-11(10)16/h1-7,15-16H.
What are the key properties of 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide?
2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide has a molecular weight of 285.27 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide is sourced from PubChem (CID 43090875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).