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MK-2206 2HCl 2mg

CAT: 0628-A10003-2Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0628-A10003-2Size:2 mg
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CAS Number
1032350-13-2

Chemical Information

MK-2206 dihydrochloride
CAS Number1032350-13-2
PubChem CID46930998
IUPAC Name8-[4-(1-aminocyclobutyl)phenyl]-9-phenyl-2H-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-3-one;dihydrochloride
Molecular FormulaC25H23Cl2N5O
Molecular Weight480.4
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count33
Formal Charge0
Complexity760
SMILES
C1CC(C1)(C2=CC=C(C=C2)C3=C(C=C4C(=N3)C=CN5C4=NNC5=O)C6=CC=CC=C6)N.Cl.Cl
InChI
InChI=1S/C25H21N5O.2ClH/c26-25(12-4-13-25)18-9-7-17(8-10-18)22-19(16-5-2-1-3-6-16)15-20-21(27-22)11-14-30-23(20)28-29-24(30)31;;/h1-3,5-11,14-15H,4,12-13,26H2,(H,29,31);2*1H
InChIKey
HWUHTJIKQZZBRA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of MK-2206 dihydrochloride
CAS: 1032350-13-2
CID: 46930998
Formula: C25H23Cl2N5O
MW: 480.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight480.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass479.1279658
Monoisotopic Mass479.1279658
Topological Polar Surface Area83.6 Ų
Heavy Atom Count33
Formal Charge0
Complexity760
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

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Alternative Products

CatalogName
ENZ-CHM164-0005MK-2206 . 2HCl
C07498-01MK-2206 2HCl
T62609-01MK-2206

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