2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide

C11H8Cl2N2O3S — CID 113353666

IUPAC2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(O)c(Cl)c1)c1cccnc1Cl
InChIInChI=1S/C11H8Cl2N2O3S/c12-8-6-7(3-4-9(8)16)15-19(17,18)10-2-1-5-14-11(10)13/h1-6,15-16H
InChIKeyQFEZIVGKBOSROK-UHFFFAOYSA-N
MW319.17 g/mol
LogP2.89
Rot. Bonds3

About 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide

2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide (PubChem CID 113353666) has the molecular formula C11H8Cl2N2O3S and a molecular weight of 319.17 g/mol. Its IUPAC name is 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide
PubChem CID113353666
Molecular FormulaC11H8Cl2N2O3S
Molecular Weight319.17 g/mol
Exact Mass317.96
IUPAC Name2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(O)c(Cl)c1)c1cccnc1Cl
InChIInChI=1S/C11H8Cl2N2O3S/c12-8-6-7(3-4-9(8)16)15-19(17,18)10-2-1-5-14-11(10)13/h1-6,15-16H
InChIKeyQFEZIVGKBOSROK-UHFFFAOYSA-N
XLogP2.89
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.17
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfonamide_B(41)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(2-hydroxyphenyl)pyridine-3-sulfonamide
CID 113220656
2-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-sulfonamide
CID 62811983
2-chloro-N-(4-propan-2-ylphenyl)pyridine-3-sulfonamide
CID 43388271
2-chloro-N-(4-methylsulfonylphenyl)pyridine-3-sulfonamide
CID 24621363
2-chloro-N-(3,4,5-trifluorophenyl)pyridine-3-sulfonamide
CID 62814206
2-chloro-N-[3-[(2-chlorophenyl)sulfamoyl]-4-methylphenyl]pyridine-3-sulfonamide
CID 24621317
5,6-dichloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide
CID 103930794
2-chloro-N-(2,6-dichlorophenyl)pyridine-3-sulfonamide
CID 60721815
2-chloro-N-(3-ethylphenyl)pyridine-3-sulfonamide
CID 24621325
4-[(2-chloro-3-pyridinyl)sulfonylamino]-N,N-dimethylbenzamide
CID 24650939
N-[4-[(2-chloro-3-pyridinyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 24650969
2-chloro-N-pyridin-2-ylpyridine-3-sulfonamide
CID 43415000

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide (CID 113353666) is 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide is O=S(=O)(Nc1ccc(O)c(Cl)c1)c1cccnc1Cl.
What is the InChIKey of 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide?
The InChIKey is QFEZIVGKBOSROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2O3S/c12-8-6-7(3-4-9(8)16)15-19(17,18)10-2-1-5-14-11(10)13/h1-6,15-16H.
What are the key properties of 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide?
2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide has a molecular weight of 319.17 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 113353666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).