5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide

C12H10Cl2N2O3S — CID 64606325

IUPAC5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide
SMILESCc1cc(O)ccc1NS(=O)(=O)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C12H10Cl2N2O3S/c1-7-4-8(17)2-3-11(7)16-20(18,19)9-5-10(13)12(14)15-6-9/h2-6,16-17H,1H3
InChIKeyWUNOMOIHMUOSGK-UHFFFAOYSA-N
MW333.20 g/mol
LogP3.20
Rot. Bonds3

About 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide

5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide (PubChem CID 64606325) has the molecular formula C12H10Cl2N2O3S and a molecular weight of 333.20 g/mol. Its IUPAC name is 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide
PubChem CID64606325
Molecular FormulaC12H10Cl2N2O3S
Molecular Weight333.20 g/mol
Exact Mass331.98
IUPAC Name5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide
SMILESCc1cc(O)ccc1NS(=O)(=O)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C12H10Cl2N2O3S/c1-7-4-8(17)2-3-11(7)16-20(18,19)9-5-10(13)12(14)15-6-9/h2-6,16-17H,1H3
InChIKeyWUNOMOIHMUOSGK-UHFFFAOYSA-N
XLogP3.20
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.20
LogP ≤ 53.20
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

4-chloro-N-(4-hydroxy-2-methylphenyl)benzenesulfonamide
CID 3315949
N-(5-acetyl-2-methylphenyl)-5,6-dichloropyridine-3-sulfonamide
CID 110618393
3-bromo-4-chloro-N-(4-hydroxy-2-methylphenyl)benzenesulfonamide
CID 106606177
5,6-dichloro-N-(2,4,5-trichlorophenyl)pyridine-3-sulfonamide
CID 4731003
5,6-dichloro-N-(2,6-difluorophenyl)pyridine-3-sulfonamide
CID 64625188
4-chloro-N-(4-hydroxy-2-methylphenyl)-1-methylpyrazole-5-sulfonamide
CID 106147360
5,6-dichloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-sulfonamide
CID 103930794
2-[(5,6-dichloro-3-pyridinyl)sulfonylamino]benzoic acid
CID 64607834
methyl 2-[(5,6-dichloro-3-pyridinyl)sulfonylamino]benzoate
CID 4730940
5,6-dichloro-N-(2,4,6-triiodophenyl)pyridine-3-sulfonamide
CID 64607451
5,6-dichloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-sulfonamide
CID 64782411
6-amino-5-chloro-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 64608701

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide?
The IUPAC name of 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide (CID 64606325) is 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide is Cc1cc(O)ccc1NS(=O)(=O)c1cnc(Cl)c(Cl)c1.
What is the InChIKey of 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide?
The InChIKey is WUNOMOIHMUOSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O3S/c1-7-4-8(17)2-3-11(7)16-20(18,19)9-5-10(13)12(14)15-6-9/h2-6,16-17H,1H3.
What are the key properties of 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide?
5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide has a molecular weight of 333.20 g/mol, XLogP of 3.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-N-(4-hydroxy-2-methylphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64606325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).