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Methisazone

CAT: 0931-T24455-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T24455-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1910-68-5
Target
SARS-CoV, Others, Virus Protease
Related Pathways
Microbiology/Virology, Others
Bioactivity
Methisazone is an effective antiviral agent against poxviruses.
Smiles
N(NC(N)=S)=C1C=2C(N(C)C1=O)=CC=CC2
Molecular Formula
C10H10N4OS
Molecular Weight
234.28
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Methisazone

Metisazone is a member of indoles.

CAS Number1910-68-5
PubChem CID667492
IUPAC Name(2-hydroxy-1-methylindol-3-yl)iminothiourea
Molecular FormulaC10H10N4OS
Molecular Weight234.28
XLogP2
Topological Polar Surface Area108
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count16
Formal Charge0
Complexity309
SMILES
CN1C2=CC=CC=C2C(=C1O)N=NC(=S)N
InChI
InChI=1S/C10H10N4OS/c1-14-7-5-3-2-4-6(7)8(9(14)15)12-13-10(11)16/h2-5,15H,1H3,(H2,11,16)
InChIKey
TTZUCVNWOZLIGL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methisazone
CAS: 1910-68-5
CID: 667492
Formula: C10H10N4OS
MW: 234.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight234.28
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass234.05753213
Monoisotopic Mass234.05753213
Topological Polar Surface Area108 Ų
Heavy Atom Count16
Formal Charge0
Complexity309
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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