2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide

C10H6Cl2FN3O2S — CID 104821040

IUPAC2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide
SMILESO=S(=O)(Nc1cncc(Cl)n1)c1ccc(F)cc1Cl
InChIInChI=1S/C10H6Cl2FN3O2S/c11-7-3-6(13)1-2-8(7)19(17,18)16-10-5-14-4-9(12)15-10/h1-5H,(H,15,16)
InChIKeySWANQBAYTVGGTC-UHFFFAOYSA-N
MW322.15 g/mol
LogP2.72
Rot. Bonds3

About 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide

2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide (PubChem CID 104821040) has the molecular formula C10H6Cl2FN3O2S and a molecular weight of 322.15 g/mol. Its IUPAC name is 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide
PubChem CID104821040
Molecular FormulaC10H6Cl2FN3O2S
Molecular Weight322.15 g/mol
Exact Mass320.95
IUPAC Name2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide
SMILESO=S(=O)(Nc1cncc(Cl)n1)c1ccc(F)cc1Cl
InChIInChI=1S/C10H6Cl2FN3O2S/c11-7-3-6(13)1-2-8(7)19(17,18)16-10-5-14-4-9(12)15-10/h1-5H,(H,15,16)
InChIKeySWANQBAYTVGGTC-UHFFFAOYSA-N
XLogP2.72
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.15
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide
CID 113456932
2-chloro-N-(6-chloropyrazin-2-yl)-4-methylbenzenesulfonamide
CID 113456936
6-[(2-chloro-4-fluorophenyl)sulfonylamino]pyridine-2-carboxylic acid
CID 63643790
2-chloro-N-(4-chloro-2-pyridinyl)-4-fluorobenzenesulfonamide
CID 113251215
6-chloro-N-(2-chloro-5-fluorophenyl)pyrazin-2-amine
CID 107530585
N-(6-chloro-2-pyridinyl)-2,5-difluorobenzenesulfonamide
CID 104821362
2-chloro-N-[2-[(2-chloro-4-fluorophenyl)sulfonylamino]ethyl]-4-fluorobenzenesulfonamide
CID 52565640
N-(6-chloropyrazin-2-yl)-2,4,6-trimethylbenzenesulfonamide
CID 104821077
6-chloro-N-[1-(2-chloro-4-fluorophenyl)ethyl]pyrazin-2-amine
CID 133305089
N-(1H-benzimidazol-2-yl)-2-chloro-4-fluorobenzenesulfonamide
CID 63563133
N-(6-chloropyrazin-2-yl)-4-propan-2-ylbenzenesulfonamide
CID 104821005
N-(6-chloro-2-pyridinyl)-5-fluoro-2-methylbenzenesulfonamide
CID 113456965

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide?
The IUPAC name of 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide (CID 104821040) is 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide.
What is the SMILES notation for 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide?
The canonical SMILES for 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide is O=S(=O)(Nc1cncc(Cl)n1)c1ccc(F)cc1Cl.
What is the InChIKey of 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide?
The InChIKey is SWANQBAYTVGGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2FN3O2S/c11-7-3-6(13)1-2-8(7)19(17,18)16-10-5-14-4-9(12)15-10/h1-5H,(H,15,16).
What are the key properties of 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide?
2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide has a molecular weight of 322.15 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(6-chloropyrazin-2-yl)-4-fluorobenzenesulfonamide is sourced from PubChem (CID 104821040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).