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CP-91149

CAT: 1410-M18152-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1410-M18152-07Size:100 mg
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Description
CP-91149 is a selective glycogen phosphorylase (GP) inhibitor with IC50 of 0.13 μM in the presence of glucose, 5- to 10-fold less potent in the absence of glucose.
CAS Number
186392-40-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
399.87
Molecular Formula
C21H22ClN3O3
Notes
Research use only, not for human use.
Receptor
Glycogen phosphorylase (GP)

Chemical Information

CP-91149

inhibits liver glycogen phosphorylase; structure in first source

CAS Number186392-40-5
PubChem CID9843900
IUPAC Name5-chloro-N-[(2S,3R)-4-(dimethylamino)-3-hydroxy-4-oxo-1-phenylbutan-2-yl]-1H-indole-2-carboxamide
Molecular FormulaC21H22ClN3O3
Molecular Weight399.9
XLogP3.2
Topological Polar Surface Area85.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity553
SMILES
CN(C)C(=O)[C@@H]([C@H](CC1=CC=CC=C1)NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl)O
InChI
InChI=1S/C21H22ClN3O3/c1-25(2)21(28)19(26)17(10-13-6-4-3-5-7-13)24-20(27)18-12-14-11-15(22)8-9-16(14)23-18/h3-9,11-12,17,19,23,26H,10H2,1-2H3,(H,24,27)/t17-,19+/m0/s1
InChIKey
HINJNZFCMLSBCI-PKOBYXMFSA-N
Chemical Structure
2D Structure
2D structure of CP-91149
CAS: 186392-40-5
CID: 9843900
Formula: C21H22ClN3O3
MW: 399.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight399.9
XLogP33.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass399.1349693
Monoisotopic Mass399.1349693
Topological Polar Surface Area85.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity553
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
HY-13525-01CP-91149
FC20583-01CP 91149

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