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Sulfachlorpyrazine

HCID 164867
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1672-91-9
Standard SMILES
Nc1ccc(S(=O)(=O)Nc2cnc(Cl)cn2)cc1
InChIKey
GDANWVKBBCWCIJ-UHFFFAOYSA-N
Molecular formula
C10H9ClN4O2S
Average molar mass
284.72 g/mol
Monoisotopic mass
284.0134744

Overview

Sulfachlorpyrazine is a sulfonamide containing a 5-chloropyrazin-2-yl moiety linked to the amide nitrogen; principally used in veterinary medicine.

Names & identifiers

Preferred name
Sulfachlorpyrazine
IUPAC
4-amino-N-(5-chloropyrazin-2-yl)benzenesulfonamide
English name
sulfachlorpyrazine
Molecular formula
C10H9ClN4O2S
Molecular weight
284.72

Names & synonyms

Sulfachlorpyrazine1672-91-9Sulphachloropyrazine96R84UZ2XACHEBI:145370Benzenesulfonamide, 4-amino-N-(5-chloropyrazinyl)-4-Amino-N-(5-chloropyrazinyl)benzenesulfonamideRefChem:186476Sulfachloropyrazine4-amino-n-(5-chloropyrazin-2-yl)benzenesulfonamide4-amino-N-(5-chloropyrazin-2-yl)benzene-1-sulfonamideMFCD30481446
Show more names
BENZENESULFONAMIDE, 4-AMINO-N-(5-CHLORO-2-PYRAZINYL)-Epitope ID:952466UNII-96R84UZ2XASCHEMBL6752479DTXSID50937296Sulfachlorpyrazine in acetonitrileAKOS025402285AC-7628

Database identifiers

CAS
1672-91-9
PubChem CID
164867
DTXSID
DTXSID50937296
ChEBI
CHEBI:145370
UNII
96R84UZ2XA
Nikkaji
J291.100K

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
106 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
365

Experimental & physicochemical properties

LogP0.25

Physicochemical properties

Melting point
211.9 · 211.9-213.7 °C
Boiling point
497.7 · 497.7±55.0 °C(Predicted)
Density
1.588 · 1.588±0.06 g/cm3(Predicted)
pka
5.65 · 5.65±0.10(Predicted)
FDA UNII
96 R84UZ2XA · 96R84UZ2XA

Chemistry & industry

Suppliers3 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
兰州康寓信生物科技有限公司0943-8293106 · [email protected]

Additional notes

DefinitionChEBI: Sulfachlorpyrazine is a sulfonamide containing a 5-chloropyrazin-2-yl moiety linked to the amide nitrogen; principally used in veterinary medicine.

Related reactions

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Compound notes

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