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PIK-108

CAT: 0013-GTR19154799-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19154799-01Size:200 mg
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Description
PIK-108 is an allosteric inhibitor of phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunits β and δ (PI3Kβ/δ) .
CAS Number
901398-68-3
Product Name Alternative
PIK 108 | PIK108
Purity
>98% (HPLC)
Solubility
DMSO:45 mg/mL (123.48 mM; Need ultrasonic)
Smiles
O=C1C=C (N2CCOCC2) OC3=C (C (NC4=CC=CC=C4) C) C=C (C) C=C13
Molecular Formula
C22H24N2O3
Molecular Weight
364.44
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

4H-1-Benzopyran-4-one, 6-methyl-2-(4-morpholinyl)-8-[1-(phenylamino)ethyl]-
CAS Number901398-68-3
PubChem CID70686584
IUPAC Name8-(1-anilinoethyl)-6-methyl-2-morpholin-4-ylchromen-4-one
Molecular FormulaC22H24N2O3
Molecular Weight364.4
XLogP3.7
Topological Polar Surface Area50.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity552
SMILES
CC1=CC2=C(C(=C1)C(C)NC3=CC=CC=C3)OC(=CC2=O)N4CCOCC4
InChI
InChI=1S/C22H24N2O3/c1-15-12-18(16(2)23-17-6-4-3-5-7-17)22-19(13-15)20(25)14-21(27-22)24-8-10-26-11-9-24/h3-7,12-14,16,23H,8-11H2,1-2H3
InChIKey
VRCXIJAYLCUSHC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4H-1-Benzopyran-4-one, 6-methyl-2-(4-morpholinyl)-8-[1-(phenylamino)ethyl]-
CAS: 901398-68-3
CID: 70686584
Formula: C22H24N2O3
MW: 364.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight364.4
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass364.17869263
Monoisotopic Mass364.17869263
Topological Polar Surface Area50.8 Ų
Heavy Atom Count27
Formal Charge0
Complexity552
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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