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MK-0159

CAT: 0931-T61933-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T61933-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2641484-61-7
Target
CD38
Related Pathways
Immunology/Inflammation
Purity
0.9972
Bioactivity
MK-0159 is an orally available, highly potent CD38 inhibitor with myocardial injury protection for the study of cardiac ischemia and reperfusion injury.
Smiles
COCCO[C@H]1CC[C@@H](CC1)NC(=O)c1cc(nc2[nH]ccc12)-c1cncs1
Molecular Formula
C20H24N4O3S
Molecular Weight
400.495
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(trans-4-(2-Methoxyethoxy)cyclohexyl)-6-(thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridine-4-carboxamide
CAS Number2641484-61-7
PubChem CID156339417
IUPAC NameN-[4-(2-methoxyethoxy)cyclohexyl]-6-(1,3-thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridine-4-carboxamide
Molecular FormulaC20H24N4O3S
Molecular Weight400.5
XLogP2.4
Topological Polar Surface Area117
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity518
SMILES
COCCOC1CCC(CC1)NC(=O)C2=CC(=NC3=C2C=CN3)C4=CN=CS4
InChI
InChI=1S/C20H24N4O3S/c1-26-8-9-27-14-4-2-13(3-5-14)23-20(25)16-10-17(18-11-21-12-28-18)24-19-15(16)6-7-22-19/h6-7,10-14H,2-5,8-9H2,1H3,(H,22,24)(H,23,25)
InChIKey
JUVJFMVGYBBDKN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(trans-4-(2-Methoxyethoxy)cyclohexyl)-6-(thiazol-5-yl)-1H-pyrrolo[2,3-b]pyridine-4-carboxamide
CAS: 2641484-61-7
CID: 156339417
Formula: C20H24N4O3S
MW: 400.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight400.5
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass400.15691181
Monoisotopic Mass400.15691181
Topological Polar Surface Area117 Ų
Heavy Atom Count28
Formal Charge0
Complexity518
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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BUP02199-01MK-0159
A24359-50MK-0159 50mg
A24359-100MK-0159 100mg
A24359-10MK-0159 10mg
A24359-5MK-0159 5mg
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