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NSC-87877 disodium

CAT: 0931-T6911-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T6911-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
56932-43-5
Target
Phosphatase, Apoptosis
Related Pathways
Metabolism, Apoptosis
Purity
0.98
Bioactivity
NSC-87877 disodium (NSC87877) is a cell-permeable inhibitor of both SHP-1 and SHP-2 with IC50 values of 355 and 318 nM respectively. It also inhibits EGF-induced Erk1/2 activation in HEK293 cells and significantly reduces MDA-MB-468 cell viability/proliferation.
Smiles
[Na+].[Na+].Oc1c(cc(c2cccnc12)S([O-])(=O)=O)\N=N\c1ccc2cc(ccc2c1)S([O-])(=O)=O
Molecular Formula
C19H13N3O7S2·2Na
Molecular Weight
503.42
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-Quinolinesulfonic acid, 8-hydroxy-7-[2-(6-sulfo-2-naphthalenyl)diazenyl]-, sodium salt (1:2)
CAS Number56932-43-5
PubChem CID92576
IUPAC Namedisodium;8-hydroxy-7-[(6-sulfonatonaphthalen-2-yl)diazenyl]quinoline-5-sulfonate
Molecular FormulaC19H11N3Na2O7S2
Molecular Weight503.4
Topological Polar Surface Area189
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count2
Heavy Atom Count33
Formal Charge0
Complexity857
SMILES
C1=CC2=C(C=C(C(=C2N=C1)O)N=NC3=CC4=C(C=C3)C=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
InChI
InChI=1S/C19H13N3O7S2.2Na/c23-19-16(10-17(31(27,28)29)15-2-1-7-20-18(15)19)22-21-13-5-3-12-9-14(30(24,25)26)6-4-11(12)8-13;;/h1-10,23H,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2
InChIKey
IFVGQKHFUZRWNA-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of 5-Quinolinesulfonic acid, 8-hydroxy-7-[2-(6-sulfo-2-naphthalenyl)diazenyl]-, sodium salt (1:2)
CAS: 56932-43-5
CID: 92576
Formula: C19H11N3Na2O7S2
MW: 503.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight503.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count2
Exact Mass502.98338061
Monoisotopic Mass502.98338061
Topological Polar Surface Area189 Ų
Heavy Atom Count33
Formal Charge0
Complexity857
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