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YEATS Inhibitor 7

CAT: 0013-GTR19241955-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19241955-01Size:10 mg
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Description
YEATS Inhibitor 7 is a small molecule that selectively targets the ENL YEATS domain, a key epigenetic reader in leukemia. It is used in research to investigate oncogenic mechanisms and has demonstrated activity in both cellular assays and in vivo models of acute leukemia.
CAS Number
2803461-76-7
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C (NCC1=CC=C (C=C1) CN (C) C) C=2C=CC3=NN=CN3C2
Molecular Formula
C17H19N5O
Molecular Weight
309.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(4-((Dimethylamino)methyl)benzyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CAS Number2803461-76-7
PubChem CID164186581
IUPAC NameN-[[4-[(dimethylamino)methyl]phenyl]methyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Molecular FormulaC17H19N5O
Molecular Weight309.4
XLogP1.8
Topological Polar Surface Area62.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity394
SMILES
CN(C)CC1=CC=C(C=C1)CNC(=O)C2=CN3C=NN=C3C=C2
InChI
InChI=1S/C17H19N5O/c1-21(2)10-14-5-3-13(4-6-14)9-18-17(23)15-7-8-16-20-19-12-22(16)11-15/h3-8,11-12H,9-10H2,1-2H3,(H,18,23)
InChIKey
INYAZFZIPMYIQV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-((Dimethylamino)methyl)benzyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CAS: 2803461-76-7
CID: 164186581
Formula: C17H19N5O
MW: 309.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight309.4
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass309.15896025
Monoisotopic Mass309.15896025
Topological Polar Surface Area62.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity394
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

CatalogName
T202583-01YEATS Inhibitor 7
TBI4046-5MGSGC-iMLLT, MLLT1/3 YEATS domain inhibitor
339876YEATS domain containing 4
abx262488-01YEATS Domain Containing 4 Protein
495752YEATS2 (YEATS Domain-Containing Protein 2)
abx027093-01YEATS Domain Containing 4 (YEATS4) Antibody
abx239562YEATS Domain Containing 2 (YEATS2) Antibody
rAP-3768YEATS Domain Containing 4 Human Recombinant
495754YEATS4 (YEATS Domain-containing Protein 4)
32-5261-10Recombinant Human YEATS Domain Containing 4

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