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DMX-5804

CAT: 0013-GTR19162669-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19162669-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
DMX-5804 (DMX5804) is a potent, selective small-molecule inhibitor of MAP4K4 with IC50 of 3 nM; displays >100-fold selectivity over GCK/MAP4K2, GLK/MAP4K3, KHS/MAP4K5 and VEGFR; rescues cell survival, mitochondrial function, and calcium cycling in hiPSC-CMs (human induced-pluripotent-stem-cell-derived cardiomyocytes), protects hiPSC-CMs with EC50 of 500 nM for cell death induced by 400 uM H2O2; reduces infarct size and ischemia-reperfusion injury in mice in mice.
CAS Number
2306178-56-1
Product Name Alternative
DMX5804 | DMX 5804
Purity
>98% (HPLC)
Solubility
DMSO : 125 mg/mL 345.89 mM
Smiles
O=C1NC=NC2=C1C (C3=CC=C (OCCOC) C=C3) =CN2C4=CC=CC=C4
Molecular Formula
C21H19N3O3
Molecular Weight
361.401
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
5- (4- (2-methoxyethoxy) phenyl) -7-phenyl-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one

Chemical Information

5-[4-(2-methoxyethoxy)phenyl]-7-phenyl-3H-pyrrolo[2,3-d]pyrimidin-4-one
CAS Number2306178-56-1
PubChem CID137334091
IUPAC Name5-[4-(2-methoxyethoxy)phenyl]-7-phenyl-3H-pyrrolo[2,3-d]pyrimidin-4-one
Molecular FormulaC21H19N3O3
Molecular Weight361.4
XLogP2.9
Topological Polar Surface Area64.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity527
SMILES
COCCOC1=CC=C(C=C1)C2=CN(C3=C2C(=O)NC=N3)C4=CC=CC=C4
InChI
InChI=1S/C21H19N3O3/c1-26-11-12-27-17-9-7-15(8-10-17)18-13-24(16-5-3-2-4-6-16)20-19(18)21(25)23-14-22-20/h2-10,13-14H,11-12H2,1H3,(H,22,23,25)
InChIKey
FUSHFOGORKZNNQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-[4-(2-methoxyethoxy)phenyl]-7-phenyl-3H-pyrrolo[2,3-d]pyrimidin-4-one
CAS: 2306178-56-1
CID: 137334091
Formula: C21H19N3O3
MW: 361.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight361.4
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass361.14264148
Monoisotopic Mass361.14264148
Topological Polar Surface Area64.9 Ų
Heavy Atom Count27
Formal Charge0
Complexity527
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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BA6480-5DMX-5804
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A20199-5DMX-5804 5mg
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A20199-100DMX-5804 100mg
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