Products for Research Use Only
RegisterLogin

GNF-5

CAT: 0931-T1803-05Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T1803-05Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
778277-15-9
Target
SARS-CoV, Bcr-Abl
Related Pathways
Tyrosine Kinase/Adaptors, Cytoskeletal Signaling, Angiogenesis, Microbiology/Virology
Purity
0.9998
Bioactivity
GNF-5 is a specific non-ATP competitive inhibitor of Bcr-Abl (IC50: 0.22±0.1 uM, Wild-type Abl) . It is an analog of GNF-2 with improved pharmacokinetic properties.
Smiles
N(C1=CC(=NC=N1)C2=CC(C(NCCO)=O)=CC=C2)C3=CC=C(OC(F)(F)F)C=C3
Molecular Formula
C20H17F3N4O3
Molecular Weight
418.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(2-hydroxyethyl)-3-(6-((4-(trifluoromethoxy)phenyl)amino)-4-pyrimidinyl)benzamide

a non-receptor tyrosine kinase inhibitor

CAS Number778277-15-9
PubChem CID44129660
IUPAC NameN-(2-hydroxyethyl)-3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzamide
Molecular FormulaC20H17F3N4O3
Molecular Weight418.4
XLogP3.5
Topological Polar Surface Area96.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Heavy Atom Count30
Formal Charge0
Complexity544
SMILES
C1=CC(=CC(=C1)C(=O)NCCO)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F
InChI
InChI=1S/C20H17F3N4O3/c21-20(22,23)30-16-6-4-15(5-7-16)27-18-11-17(25-12-26-18)13-2-1-3-14(10-13)19(29)24-8-9-28/h1-7,10-12,28H,8-9H2,(H,24,29)(H,25,26,27)
InChIKey
IIQUYGWWHIHOCF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-hydroxyethyl)-3-(6-((4-(trifluoromethoxy)phenyl)amino)-4-pyrimidinyl)benzamide
CAS: 778277-15-9
CID: 44129660
Formula: C20H17F3N4O3
MW: 418.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight418.4
XLogP33.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass418.12527490
Monoisotopic Mass418.12527490
Topological Polar Surface Area96.4 Ų
Heavy Atom Count30
Formal Charge0
Complexity544
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

Related Products

CatalogName
T11444-01GNF-6231
T6097-01GNF-5837
T31983-01GNF-1331
T1817-01GNF-2
T86517-01GNF-6
T71267-01GNF-8625
T3196-01GNF-7
T31984GNF-5326
T210186-01GNF-2-deg
T10199-01GNF-PF-3777

Alternative Products

CatalogName
A8604-100GNF 5
451396-01GNF-5

Popular Products