Products for Research Use Only
RegisterLogin

LY2784544

CAT: 0607-A4147-50Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0607-A4147-50Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
JAK2 inhibitor,highly potent and selective
CAS Number
1229236-86-5
Product Name Alternative
3-[(4-chloro-2-fluorophenyl)methyl]-2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-8-(morpholin-4-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
Field of Research
Chromatin Epigenetics JAK JAK STAT Signaling JAK
Purity
0.98
Form
A solid
Solubility
≥23.5 mg/mL in DMSO; insoluble in H2O; ≥5.65 mg/mL in EtOH with gentle warming and ultrasonic
Smiles
CC1=CC(=NN1)NC2=NN3C(=C(N=C3C(=C2)CN4CCOCC4)C)CC5=C(C=C(C=C5)Cl)F
Molecular Formula
C23H25ClFN7O
Molecular Weight
469.94
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Gandotinib

Gandotinib is a member of pyridazines.

CAS Number1229236-86-5
PubChem CID46213929
IUPAC Name3-[(4-chloro-2-fluorophenyl)methyl]-2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-8-(morpholin-4-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
Molecular FormulaC23H25ClFN7O
Molecular Weight469.9
XLogP3.8
Topological Polar Surface Area83.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity644
SMILES
CC1=CC(=NN1)NC2=NN3C(=C(N=C3C(=C2)CN4CCOCC4)C)CC5=C(C=C(C=C5)Cl)F
InChI
InChI=1S/C23H25ClFN7O/c1-14-9-21(29-28-14)27-22-11-17(13-31-5-7-33-8-6-31)23-26-15(2)20(32(23)30-22)10-16-3-4-18(24)12-19(16)25/h3-4,9,11-12H,5-8,10,13H2,1-2H3,(H2,27,28,29,30)
InChIKey
SQSZANZGUXWJEA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Gandotinib
CAS: 1229236-86-5
CID: 46213929
Formula: C23H25ClFN7O
MW: 469.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight469.9
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass469.1793143
Monoisotopic Mass469.1793143
Topological Polar Surface Area83.4 Ų
Heavy Atom Count33
Formal Charge0
Complexity644
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
MBS8506175-01LY2784544
A10546-100LY2784544 100mg
S2179-50mgGandotinib (LY2784544)
MBS385533-01LY2784544 (Gandotinib)
A10546-5LY2784544 5mg
A10546-25LY2784544 25mg
A10546-10LY2784544 10mg

Popular Products