N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide

C12H9ClFNO3S — CID 81241185

IUPACN-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide
SMILESO=S(=O)(Nc1cc(Cl)ccc1F)c1ccccc1O
InChIInChI=1S/C12H9ClFNO3S/c13-8-5-6-9(14)10(7-8)15-19(17,18)12-4-2-1-3-11(12)16/h1-7,15-16H
InChIKeyZLJRCGLXDHIHLM-UHFFFAOYSA-N
MW301.73 g/mol
LogP2.99
Rot. Bonds3

About N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide

N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide (PubChem CID 81241185) has the molecular formula C12H9ClFNO3S and a molecular weight of 301.73 g/mol. Its IUPAC name is N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide
PubChem CID81241185
Molecular FormulaC12H9ClFNO3S
Molecular Weight301.73 g/mol
Exact Mass301.00
IUPAC NameN-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide
SMILESO=S(=O)(Nc1cc(Cl)ccc1F)c1ccccc1O
InChIInChI=1S/C12H9ClFNO3S/c13-8-5-6-9(14)10(7-8)15-19(17,18)12-4-2-1-3-11(12)16/h1-7,15-16H
InChIKeyZLJRCGLXDHIHLM-UHFFFAOYSA-N
XLogP2.99
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.73
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide
CID 43455202
N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 9238961
5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide
CID 110759379
N-(2-fluoro-4-methylphenyl)-2-hydroxybenzenesulfonamide
CID 81241392
4-bromo-N-(5-chloro-2-fluorophenyl)-2-fluorobenzenesulfonamide
CID 116528139
N-(5-chloro-2-hydroxyphenyl)-2,4-difluorobenzenesulfonamide
CID 43244390
4-chloro-1-fluoro-2-(sulfamoylamino)benzene
CID 112573776
N-(5-chloro-2-fluorophenyl)-2-cyanopyridine-3-sulfonamide
CID 106595617
2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide
CID 43090875
2-amino-N-(5-chloro-2-fluorophenyl)-4-fluorobenzenesulfonamide
CID 43438207
N-(5-chloro-2-methoxyphenyl)-2-fluorobenzenesulfonamide
CID 2696930
N-(4-chloro-2-hydroxyphenyl)-2,4,6-trifluorobenzenesulfonamide
CID 81422193

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide?
The IUPAC name of N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide (CID 81241185) is N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide.
What is the SMILES notation for N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide?
The canonical SMILES for N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide is O=S(=O)(Nc1cc(Cl)ccc1F)c1ccccc1O.
What is the InChIKey of N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide?
The InChIKey is ZLJRCGLXDHIHLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO3S/c13-8-5-6-9(14)10(7-8)15-19(17,18)12-4-2-1-3-11(12)16/h1-7,15-16H.
What are the key properties of N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide?
N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide has a molecular weight of 301.73 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide is sourced from PubChem (CID 81241185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).