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ML167

CAT: 1410-M11167-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:1410-M11167-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
A potent, selective CDC-like kinase 4 (CLK4) inhibitor with IC50 of 136 nM, >10-fold selectivity over Clk1, Clk2, Clk3, Dyrk1A/1B.
CAS Number
1285702-20-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
335.363
Molecular Formula
C19H17N3O3
Notes
Research use only, not for human use.
Receptor
CLK1|CLK2|CLK4|Dyrk1B

Chemical Information

(5-(4-(((5-Methylfuran-2-yl)methyl)amino)quinazolin-6-yl)furan-2-yl)methanol

[5-[4-[(5-methyl-2-furanyl)methylamino]-6-quinazolinyl]-2-furanyl]methanol is a member of quinazolines.

CAS Number1285702-20-6
PubChem CID44968231
IUPAC Name[5-[4-[(5-methylfuran-2-yl)methylamino]quinazolin-6-yl]furan-2-yl]methanol
Molecular FormulaC19H17N3O3
Molecular Weight335.4
XLogP2.7
Topological Polar Surface Area84.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity438
SMILES
CC1=CC=C(O1)CNC2=NC=NC3=C2C=C(C=C3)C4=CC=C(O4)CO
InChI
InChI=1S/C19H17N3O3/c1-12-2-4-14(24-12)9-20-19-16-8-13(3-6-17(16)21-11-22-19)18-7-5-15(10-23)25-18/h2-8,11,23H,9-10H2,1H3,(H,20,21,22)
InChIKey
ROCFOIBAEVAOLQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (5-(4-(((5-Methylfuran-2-yl)methyl)amino)quinazolin-6-yl)furan-2-yl)methanol
CAS: 1285702-20-6
CID: 44968231
Formula: C19H17N3O3
MW: 335.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight335.4
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass335.12699141
Monoisotopic Mass335.12699141
Topological Polar Surface Area84.3 Ų
Heavy Atom Count25
Formal Charge0
Complexity438
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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