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K02288

CAT: 0607-B2286-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-B2286-50Size:50 mg
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Description
ALK inhibitor
CAS Number
1431985-92-0
Product Name Alternative
3-[6-amino-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenol
Field of Research
TGF-β Smad Signaling TGF-βR1(ALK5)
Purity
0.9991
Form
A solid
Solubility
insoluble in H2O; ≥17.6 mg/mL in DMSO; ≥2.5 mg/mL in EtOH with gentle warming and ultrasonic
Smiles
COC1=CC(=CC(=C1OC)OC)C2=C(N=CC(=C2)C3=CC(=CC=C3)O)N
Molecular Formula
C20H20N2O4
Molecular Weight
352.38
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

K02288

K02288 is potent and selective inhibitor of type I bone morphogenic protein (BMP) receptors.

CAS Number1431985-92-0
PubChem CID46173038
IUPAC Name3-[6-amino-5-(3,4,5-trimethoxyphenyl)-3-pyridinyl]phenol
Molecular FormulaC20H20N2O4
Molecular Weight352.4
XLogP3.3
Topological Polar Surface Area86.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity424
SMILES
COC1=CC(=CC(=C1OC)OC)C2=C(N=CC(=C2)C3=CC(=CC=C3)O)N
InChI
InChI=1S/C20H20N2O4/c1-24-17-9-13(10-18(25-2)19(17)26-3)16-8-14(11-22-20(16)21)12-5-4-6-15(23)7-12/h4-11,23H,1-3H3,(H2,21,22)
InChIKey
CJLMANFTWLNAKC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of K02288
CAS: 1431985-92-0
CID: 46173038
Formula: C20H20N2O4
MW: 352.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.4
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass352.14230712
Monoisotopic Mass352.14230712
Topological Polar Surface Area86.8 Ų
Heavy Atom Count26
Formal Charge0
Complexity424
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

Alternative Products

CatalogName
452980-01K02288

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