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SGI-7079

CAT: 0013-GTR19167896-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19167896-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SGI-7079
CAS Number
1239875-86-5
Product Name Alternative
FLT3, Inhibitor, HGFR, Mer, inhibit, Met, cRET, c-Met, cMet/HGFR, cMet, AXL, Axl, Tyro3, SGI 7079, SGI7079, SGI-7079, Yes, TAM Receptor, TAMReceptor, RET
Field of Research
Cardiovascular Research, Cell Biology, Signal Transduction
Purity
95.05% (May vary between batches)
Solubility
DMSO:250 mg/mL (548.81 mM) ; H2O:< 1 mg/mL (insoluble or slightly soluble) ; Ethanol:< 1 mg/mL (insoluble or slightly soluble) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (7.24 mM)
Smiles
CN1CCN (CC1) c1ccc (Nc2nc (-c3cccc (CC#N) c3) c3c (C) c[nH]c3n2) cc1F
Molecular Formula
C26H26FN7
Molecular Weight
455.53
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(3-(2-((3-Fluoro-4-(4-methylpiperazin-1-yl)phenyl)amino)-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)phenyl)acetonitrile
CAS Number1239875-86-5
PubChem CID46870258
IUPAC Name2-[3-[2-[3-fluoro-4-(4-methylpiperazin-1-yl)anilino]-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]phenyl]acetonitrile
Molecular FormulaC26H26FN7
Molecular Weight455.5
XLogP4.3
Topological Polar Surface Area83.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity719
SMILES
CC1=CNC2=NC(=NC(=C12)C3=CC=CC(=C3)CC#N)NC4=CC(=C(C=C4)N5CCN(CC5)C)F
InChI
InChI=1S/C26H26FN7/c1-17-16-29-25-23(17)24(19-5-3-4-18(14-19)8-9-28)31-26(32-25)30-20-6-7-22(21(27)15-20)34-12-10-33(2)11-13-34/h3-7,14-16H,8,10-13H2,1-2H3,(H2,29,30,31,32)
InChIKey
BCFKACXAIBEPKR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(3-(2-((3-Fluoro-4-(4-methylpiperazin-1-yl)phenyl)amino)-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)phenyl)acetonitrile
CAS: 1239875-86-5
CID: 46870258
Formula: C26H26FN7
MW: 455.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight455.5
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass455.22337202
Monoisotopic Mass455.22337202
Topological Polar Surface Area83.9 Ų
Heavy Atom Count34
Formal Charge0
Complexity719
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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