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EHT 5372

CAT: 0931-T61985-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T61985-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1425945-63-6
Target
Others, GSK-3, DYRK, CDK
Related Pathways
Others, Stem Cells, Tyrosine Kinase/Adaptors, Cell Cycle/Checkpoint, PI3K/Akt/mTOR signaling
Bioactivity
EHT 5372 is a potent and selective inhibitor of DYRK's family kinases. EHT 5372 shows IC 50 s of 0.22, 0.28, 10.8, 93.2, 22.8, 88.8, 59.0, 7.44, 221 nM for DYRK1A, DYRK1B, DYRK2, DYRK3, CLK1, CLK2, CLK4, GSK-3α, GSK-3β.
Smiles
N(C1=C2C3=C(N=C(C(OC)=N)S3)C=CC2=NC=N1)C4=C(Cl)C=C(Cl)C=C4
Molecular Formula
C17H11Cl2N5OS
Molecular Weight
404.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Methyl 9-(2,4-dichloroanilino)-[1,3]thiazolo[5,4-f]quinazoline-2-carboximidate
CAS Number1425945-63-6
PubChem CID71529610
IUPAC Namemethyl 9-(2,4-dichloroanilino)-[1,3]thiazolo[5,4-f]quinazoline-2-carboximidate
Molecular FormulaC17H11Cl2N5OS
Molecular Weight404.3
XLogP5.4
Topological Polar Surface Area112
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity529
SMILES
COC(=N)C1=NC2=C(S1)C3=C(C=C2)N=CN=C3NC4=C(C=C(C=C4)Cl)Cl
InChI
InChI=1S/C17H11Cl2N5OS/c1-25-15(20)17-24-12-5-4-11-13(14(12)26-17)16(22-7-21-11)23-10-3-2-8(18)6-9(10)19/h2-7,20H,1H3,(H,21,22,23)
InChIKey
QSGKPYRFWJINEH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 9-(2,4-dichloroanilino)-[1,3]thiazolo[5,4-f]quinazoline-2-carboximidate
CAS: 1425945-63-6
CID: 71529610
Formula: C17H11Cl2N5OS
MW: 404.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight404.3
XLogP35.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass403.0061366
Monoisotopic Mass403.0061366
Topological Polar Surface Area112 Ų
Heavy Atom Count26
Formal Charge0
Complexity529
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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