N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide

C12H8ClF2NO3S — CID 83088230

IUPACN-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide
SMILESO=S(=O)(Nc1c(F)cc(F)cc1Cl)c1ccc(O)cc1
InChIInChI=1S/C12H8ClF2NO3S/c13-10-5-7(14)6-11(15)12(10)16-20(18,19)9-3-1-8(17)2-4-9/h1-6,16-17H
InChIKeyLWFBUNHLSISFGN-UHFFFAOYSA-N
MW319.72 g/mol
LogP3.12
Rot. Bonds3

About N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide

N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide (PubChem CID 83088230) has the molecular formula C12H8ClF2NO3S and a molecular weight of 319.72 g/mol. Its IUPAC name is N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide.

Molecular Properties

Compound NameN-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide
PubChem CID83088230
Molecular FormulaC12H8ClF2NO3S
Molecular Weight319.72 g/mol
Exact Mass318.99
IUPAC NameN-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide
SMILESO=S(=O)(Nc1c(F)cc(F)cc1Cl)c1ccc(O)cc1
InChIInChI=1S/C12H8ClF2NO3S/c13-10-5-7(14)6-11(15)12(10)16-20(18,19)9-3-1-8(17)2-4-9/h1-6,16-17H
InChIKeyLWFBUNHLSISFGN-UHFFFAOYSA-N
XLogP3.12
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.72
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-(2-chloro-4,6-difluorophenyl)pyridine-3-sulfonamide
CID 82890177
4-bromo-N-(2-chloro-4,6-difluorophenyl)-3-methylbenzenesulfonamide
CID 82886303
6-amino-5-chloro-N-(2-chloro-4,6-difluorophenyl)pyridine-3-sulfonamide
CID 83074226
N-(2-chloro-4,6-difluorophenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 83073248
2-amino-5-chloro-N-(2-chloro-4,6-difluorophenyl)benzenesulfonamide
CID 83072869
N-(2-amino-4,6-difluorophenyl)-4-fluorobenzenesulfonamide
CID 81314823
N-(2-chloro-4,6-difluorophenyl)propane-1-sulfonamide
CID 83088363
5-(aminomethyl)-N-(2-chloro-4,6-difluorophenyl)-1H-pyrrole-3-sulfonamide
CID 106074619
5-[(2-chloro-4,6-difluorophenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 82888796
4-bromo-N-(2,6-dichloro-4-fluorophenyl)-3-methylbenzenesulfonamide
CID 83078624
2-bromo-N-(2-chloro-4,6-difluorophenyl)-4-methylbenzenesulfonamide
CID 82888797
4-fluoro-N-(4-hydroxyphenyl)benzenesulfonamide
CID 764850

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide?
The IUPAC name of N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide (CID 83088230) is N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide.
What is the SMILES notation for N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide?
The canonical SMILES for N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide is O=S(=O)(Nc1c(F)cc(F)cc1Cl)c1ccc(O)cc1.
What is the InChIKey of N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide?
The InChIKey is LWFBUNHLSISFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClF2NO3S/c13-10-5-7(14)6-11(15)12(10)16-20(18,19)9-3-1-8(17)2-4-9/h1-6,16-17H.
What are the key properties of N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide?
N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide has a molecular weight of 319.72 g/mol, XLogP of 3.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4,6-difluorophenyl)-4-hydroxybenzenesulfonamide is sourced from PubChem (CID 83088230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).