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MK8722

CAT: 0127-BUP05416-04Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP05416-04Size:50 mg
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CAS Number
1394371-71-1
Purity
=98%
Smiles
[H][C@]12OC[C@@H](Oc3nc4nc(c(Cl)cc4[nH]3)-c3ccc(cc3)-c3ccccc3)[C@@]1([H])OC[C@H]2O

Chemical Information

MK-8722

an AMP-activated protein kinase activator

CAS Number1394371-71-1
PubChem CID89558344
IUPAC Name(3R,3aR,6R,6aR)-6-[[6-chloro-5-(4-phenylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]oxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol
Molecular FormulaC24H20ClN3O4
Molecular Weight449.9
XLogP3.8
Topological Polar Surface Area89.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity645
SMILES
C1[C@H]([C@@H]2[C@H](O1)[C@@H](CO2)OC3=NC4=NC(=C(C=C4N3)Cl)C5=CC=C(C=C5)C6=CC=CC=C6)O
InChI
InChI=1S/C24H20ClN3O4/c25-16-10-17-23(28-24(26-17)32-19-12-31-21-18(29)11-30-22(19)21)27-20(16)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-10,18-19,21-22,29H,11-12H2,(H,26,27,28)/t18-,19-,21-,22-/m1/s1
InChIKey
XQMNBTZLYOOAGA-UGESXGAOSA-N
Chemical Structure
2D Structure
2D structure of MK-8722
CAS: 1394371-71-1
CID: 89558344
Formula: C24H20ClN3O4
MW: 449.9
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight449.9
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass449.1142338
Monoisotopic Mass449.1142338
Topological Polar Surface Area89.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity645
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA4620-50MK8722
A13392-25MK8722 25mg
A13392-10MK8722 10mg
A13392-1MK8722 1mg
A13392-100MK8722 100mg
A13392-2MK8722 2mg
A13392-50MK8722 50mg
A13392-5MK8722 5mg
A13392-10mM-DMK8722 10mM * 1mL in DMSO

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