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NSC73306

CAT: 0804-HY-141425-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-141425-02Size:5 mg
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Description
NSC73306, a thiosemicarbazone, is a cell penetrant, cytotoxic agent that exhibits greater toxicity against cells expressing functional P-gp (P-glycoprotein) than against other cells[1].
CAS Number
79560-74-0
UNSPSC
12352005
Target
P-glycoprotein
Related Pathways
Membrane Transporter/Ion Channel
Field of Research
Cancer
Smiles
O=C1NC2=C(C=CC=C2)/C1=N/NC(NC3=CC=C(OC)C=C3)=S
Molecular Formula
C16H14N4O2S
Molecular Weight
326.37
References & Citations
[1]Ludwig JA, et al. Selective toxicity of NSC73306 in MDR1-positive cells as a new strategy to circumvent multidrug resistance in cancer. Cancer Res. 2006;66 (9) :4808-4815.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

G3GZ237Put
CAS Number79560-74-0
PubChem CID3003794
IUPAC Name1-[(5,7-dichloro-2-hydroxy-1H-indol-3-yl)imino]-3-(4-methoxyphenyl)thiourea
Molecular FormulaC16H12Cl2N4O2S
Molecular Weight395.3
XLogP5.2
Topological Polar Surface Area114
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity505
SMILES
COC1=CC=C(C=C1)NC(=S)N=NC2=C(NC3=C2C=C(C=C3Cl)Cl)O
InChI
InChI=1S/C16H12Cl2N4O2S/c1-24-10-4-2-9(3-5-10)19-16(25)22-21-14-11-6-8(17)7-12(18)13(11)20-15(14)23/h2-7,20,23H,1H3,(H,19,25)
InChIKey
OJWGVIBWNCMAEK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of G3GZ237Put
CAS: 79560-74-0
CID: 3003794
Formula: C16H12Cl2N4O2S
MW: 395.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight395.3
XLogP35.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass394.0058022
Monoisotopic Mass394.0058022
Topological Polar Surface Area114 Ų
Heavy Atom Count25
Formal Charge0
Complexity505
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

Alternative Products

CatalogName
GTR19249917-01NSC73306

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