Products for Research Use Only

SPP-86

CAT: 0013-GTR19174149-03Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19174149-03Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SPP-86
CAS Number
1357349-91-7
Product Name Alternative
Inhibitor, inhibit, cRET, RET, SPP86, SPP-86, SPP 86
Field of Research
Cell Biology, Signal Transduction
Purity
98.19% (May vary between batches)
Solubility
DMSO:100 mg/mL (360.59 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:4 mg/mL (14.42 mM)
Smiles
CC (C) n1nc (C#Cc2ccccc2) c2c (N) ncnc12
Molecular Formula
C16H15N5
Molecular Weight
277.32
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Spp86
CAS Number1357349-91-7
PubChem CID66549796
IUPAC Name3-(2-phenylethynyl)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine
Molecular FormulaC16H15N5
Molecular Weight277.32
XLogP2.6
Topological Polar Surface Area69.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity417
SMILES
CC(C)N1C2=NC=NC(=C2C(=N1)C#CC3=CC=CC=C3)N
InChI
InChI=1S/C16H15N5/c1-11(2)21-16-14(15(17)18-10-19-16)13(20-21)9-8-12-6-4-3-5-7-12/h3-7,10-11H,1-2H3,(H2,17,18,19)
InChIKey
JQOIRTDBHMDWMT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Spp86
CAS: 1357349-91-7
CID: 66549796
Formula: C16H15N5
MW: 277.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight277.32
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass277.13274550
Monoisotopic Mass277.13274550
Topological Polar Surface Area69.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity417
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