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SCH 54292

CAT: 1410-M12947-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M12947-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SCH 54292 is a potent Ras-GEF interaction inhibitor with IC50 of 0.7 uM.
CAS Number
188480-51-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
520.553
Molecular Formula
C24H28N2O9S
Notes
Research use only, not for human use.
Receptor
Ras

Chemical Information

4-(Hydroxyamino)-N-(2-(naphthalen-2-yloxy)ethyl)-N-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)benzenesulfonamide
CAS Number188480-51-5
PubChem CID16082414
IUPAC Name4-(hydroxyamino)-N-(2-naphthalen-2-yloxyethyl)-N-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]benzenesulfonamide
Molecular FormulaC24H28N2O9S
Molecular Weight520.6
XLogP1.4
Topological Polar Surface Area177
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count11
Rotatable Bond Count9
Heavy Atom Count36
Formal Charge0
Complexity789
SMILES
C1=CC=C2C=C(C=CC2=C1)OCCN([C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)S(=O)(=O)C4=CC=C(C=C4)NO
InChI
InChI=1S/C24H28N2O9S/c27-14-20-21(28)22(29)23(30)24(35-20)26(36(32,33)19-9-6-17(25-31)7-10-19)11-12-34-18-8-5-15-3-1-2-4-16(15)13-18/h1-10,13,20-25,27-31H,11-12,14H2/t20-,21-,22+,23-,24-/m1/s1
InChIKey
KVPUAIYIBNDBLI-GNADVCDUSA-N
Chemical Structure
2D Structure
2D structure of 4-(Hydroxyamino)-N-(2-(naphthalen-2-yloxy)ethyl)-N-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)benzenesulfonamide
CAS: 188480-51-5
CID: 16082414
Formula: C24H28N2O9S
MW: 520.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight520.6
XLogP31.4
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count11
Rotatable Bond Count9
Exact Mass520.15155165
Monoisotopic Mass520.15155165
Topological Polar Surface Area177 Ų
Heavy Atom Count36
Formal Charge0
Complexity789
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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