4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide

C10H10N4O4S3 — CID 45028567

IUPAC4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cnccc1Sc1ccncc1S(N)(=O)=O
InChIInChI=1S/C10H10N4O4S3/c11-20(15,16)9-5-13-3-1-7(9)19-8-2-4-14-6-10(8)21(12,17)18/h1-6H,(H2,11,15,16)(H2,12,17,18)
InChIKeyJYMNSJBFCKCLMB-UHFFFAOYSA-N
MW346.42 g/mol
LogP-0.08
Rot. Bonds4

About 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide

4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide (PubChem CID 45028567) has the molecular formula C10H10N4O4S3 and a molecular weight of 346.42 g/mol. Its IUPAC name is 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide
PubChem CID45028567
Molecular FormulaC10H10N4O4S3
Molecular Weight346.42 g/mol
Exact Mass345.99
IUPAC Name4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cnccc1Sc1ccncc1S(N)(=O)=O
InChIInChI=1S/C10H10N4O4S3/c11-20(15,16)9-5-13-3-1-7(9)19-8-2-4-14-6-10(8)21(12,17)18/h1-6H,(H2,11,15,16)(H2,12,17,18)
InChIKeyJYMNSJBFCKCLMB-UHFFFAOYSA-N
XLogP-0.08
TPSA146.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.42
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-(Ethylsulfonyl)pyridine-2-sulfonamide
CID 164047
2-(Benzenesulfonyl)pyridine
CID 289829
Pyridine-3-sulfonamide
CID 232710
4-Methanesulfonylpyridine
CID 292487
4,4'-Dipyridyl Sulfide
CID 604650
3-(Piperidin-1-ylsulphonyl)pyridine
CID 3623948
4-Benzylsulfanylpyridine-3-sulfonamide
CID 901953
4-(N-Oxide-2-pyridylthio)pyridine-3-sulfonamide
CID 46703924
4-Methylthiopyridine-3-sulfonamide
CID 46703929
4-(Cyanomethylthio)pyridine-3-sulfonamide
CID 46703932
4-(2-Propynylthio)pyridine-3-sulfonamide
CID 46907399
Rcc9YY7WJ6
CID 46907400

Frequently Asked Questions

What is the IUPAC name of 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide?
The IUPAC name of 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide (CID 45028567) is 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide.
What is the SMILES notation for 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide?
The canonical SMILES for 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide is NS(=O)(=O)c1cnccc1Sc1ccncc1S(N)(=O)=O.
What is the InChIKey of 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide?
The InChIKey is JYMNSJBFCKCLMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O4S3/c11-20(15,16)9-5-13-3-1-7(9)19-8-2-4-14-6-10(8)21(12,17)18/h1-6H,(H2,11,15,16)(H2,12,17,18).
What are the key properties of 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide?
4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide has a molecular weight of 346.42 g/mol, XLogP of -0.08, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-sulfamoyl-4-pyridinyl)sulfanyl]pyridine-3-sulfonamide is sourced from PubChem (CID 45028567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).