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Zinc Pyrithione

CAT: 1568-C09887-1gSize: 1 gDry Ice: YesHazardous: No
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CAT#:1568-C09887-1gSize:1 g
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CAS Number
13463-41-7
Synonyms
OM-1563
Target
Proton Pump
Applications
Transmembrane Transporters
Smiles
C1=CC=[N+] (C (=C1) [S-]) [O-].C1=CC=[N+] (C (=C1) [S-]) [O-].[Zn+2]
Molecular Formula
C10H8N2O2S2Zn
Additionnal Information
Zinc pyrithione (OM-1563) is an antifungal and antibacterial agent disrupting membrane transport by blocking the proton pump.
Storage Conditions
2 years -80 in solvent

Chemical Information

Pyrithione Zinc

Zinc pyrithione is a fine beige granules. (NTP, 1992)

CAS Number13463-41-7
PubChem CID26041
IUPAC Namezinc bis(1-oxidopyridin-1-ium-2-thiolate)
Molecular FormulaC10H8N2O2S2Zn
Molecular Weight317.7
Topological Polar Surface Area52.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity183
SMILES
C1=CC=[N+](C(=C1)[S-])[O-].C1=CC=[N+](C(=C1)[S-])[O-].[Zn+2]
InChI
InChI=1S/2C5H5NOS.Zn/c2*7-6-4-2-1-3-5(6)8;/h2*1-4,8H;/q;;+2/p-2
InChIKey
OTPSWLRZXRHDNX-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Pyrithione Zinc
CAS: 13463-41-7
CID: 26041
Formula: C10H8N2O2S2Zn
MW: 317.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight317.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass315.931862
Monoisotopic Mass315.931862
Topological Polar Surface Area52.9 Ų
Heavy Atom Count17
Formal Charge0
Complexity183
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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