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VARACIN

CAT: 0013-GTR19241603-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19241603-01Size:10 mg
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Description
VARACIN is a low-molecular-weight anticancer agent that efficiently cleaves DNA in the presence of thiols via redox cycling. Its mechanism supports its study in both in vitro cytotoxicity assays and in vivo tumor model research for investigating novel chemotherapeutic strategies.
CAS Number
134029-48-4
Smiles
O (C=1C=C (C=2SSSSSC2C1OC) CCN) C
Molecular Formula
C10H13NO2S5
Molecular Weight
339.54
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

8,9-Dimethoxy-1,2,3,4,5-benzopentathiepin-6-ethanamine
CAS Number134029-48-4
PubChem CID179269
IUPAC Name2-(6,7-dimethoxy-1,2,3,4,5-benzopentathiepin-9-yl)ethanamine
Molecular FormulaC10H13NO2S5
Molecular Weight339.6
XLogP2.7
Topological Polar Surface Area171
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity260
SMILES
COC1=C(C2=C(C(=C1)CCN)SSSSS2)OC
InChI
InChI=1S/C10H13NO2S5/c1-12-7-5-6(3-4-11)9-10(8(7)13-2)15-17-18-16-14-9/h5H,3-4,11H2,1-2H3
InChIKey
HIKCOAGMCNIBMP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 8,9-Dimethoxy-1,2,3,4,5-benzopentathiepin-6-ethanamine
CAS: 134029-48-4
CID: 179269
Formula: C10H13NO2S5
MW: 339.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight339.6
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass338.95498453
Monoisotopic Mass338.95498453
Topological Polar Surface Area171 Ų
Heavy Atom Count18
Formal Charge0
Complexity260
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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Alternative Products

CatalogName
T202925-01VARACIN

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