5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide

C12H8Cl2N2O4S — CID 71939665

IUPAC5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NS(=O)(=O)c1cccc(Cl)c1)c1c[nH]c(=O)c(Cl)c1
InChIInChI=1S/C12H8Cl2N2O4S/c13-8-2-1-3-9(5-8)21(19,20)16-11(17)7-4-10(14)12(18)15-6-7/h1-6H,(H,15,18)(H,16,17)
InChIKeyVZSJJOWPTRTAKP-UHFFFAOYSA-N
MW347.18 g/mol
LogP1.80
Rot. Bonds3

About 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide

5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 71939665) has the molecular formula C12H8Cl2N2O4S and a molecular weight of 347.18 g/mol. Its IUPAC name is 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide
PubChem CID71939665
Molecular FormulaC12H8Cl2N2O4S
Molecular Weight347.18 g/mol
Exact Mass345.96
IUPAC Name5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NS(=O)(=O)c1cccc(Cl)c1)c1c[nH]c(=O)c(Cl)c1
InChIInChI=1S/C12H8Cl2N2O4S/c13-8-2-1-3-9(5-8)21(19,20)16-11(17)7-4-10(14)12(18)15-6-7/h1-6H,(H,15,18)(H,16,17)
InChIKeyVZSJJOWPTRTAKP-UHFFFAOYSA-N
XLogP1.80
TPSA96.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.18
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-6-oxo-N-(4-propylphenyl)sulfonyl-1H-pyridine-3-carboxamide
CID 71890957
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(3-chlorophenyl)sulfonylurea
CID 117060605
5-chloro-6-oxo-1H-pyridine-3-carbohydrazide
CID 130843008
N-(3-chlorophenyl)sulfonyl-2-methylpropanamide
CID 47269833
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CID 47269831
3-chloro-N-(3-chlorophenyl)sulfonylbenzenesulfonamide
CID 18537457
N-(benzenesulfonyl)-4-chlorobenzamide
CID 2355220
5-chloro-N-(3-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47059651
N-(3-chlorophenyl)sulfonyl-4-methylpentanamide
CID 47233055
N-(4-acetylphenyl)-5-chloro-6-oxo-1H-pyridine-3-carboxamide
CID 110861200

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide (CID 71939665) is 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide is O=C(NS(=O)(=O)c1cccc(Cl)c1)c1c[nH]c(=O)c(Cl)c1.
What is the InChIKey of 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is VZSJJOWPTRTAKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2N2O4S/c13-8-2-1-3-9(5-8)21(19,20)16-11(17)7-4-10(14)12(18)15-6-7/h1-6H,(H,15,18)(H,16,17).
What are the key properties of 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide?
5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 347.18 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 71939665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).