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CAY10505

CAT: 0607-B2182-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-B2182-10Size:10 mg
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Description
Potent PI3Kγ inhibitor
CAS Number
1218777-13-9
Product Name Alternative
(5E)-5-[[5-(4-fluorophenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dione
Field of Research
PI3K Akt mTOR Signaling PI3K
Purity
0.98
Form
A solid
Solubility
insoluble in EtOH; insoluble in H2O; ≥14.45 mg/mL in DMSO
Smiles
C1=CC(=CC=C1C2=CC=C(O2)C=C3C(=O)NC(=O)S3)F
Molecular Formula
C14H8FNO3S
Molecular Weight
289.28
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

(E)-5-((5-(4-fluorophenyl)furan-2-yl)methylene)thiazolidine-2,4-dione
CAS Number1218777-13-9
PubChem CID1204893
IUPAC Name(5E)-5-[[5-(4-fluorophenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dione
Molecular FormulaC14H8FNO3S
Molecular Weight289.28
XLogP3.1
Topological Polar Surface Area84.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity446
SMILES
C1=CC(=CC=C1C2=CC=C(O2)/C=C/3\C(=O)NC(=O)S3)F
InChI
InChI=1S/C14H8FNO3S/c15-9-3-1-8(2-4-9)11-6-5-10(19-11)7-12-13(17)16-14(18)20-12/h1-7H,(H,16,17,18)/b12-7+
InChIKey
UFBTYTGRUBUUIL-KPKJPENVSA-N
Chemical Structure
2D Structure
2D structure of (E)-5-((5-(4-fluorophenyl)furan-2-yl)methylene)thiazolidine-2,4-dione
CAS: 1218777-13-9
CID: 1204893
Formula: C14H8FNO3S
MW: 289.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight289.28
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass289.02089245
Monoisotopic Mass289.02089245
Topological Polar Surface Area84.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity446
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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