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PIK-C98

CAT: 0013-GTR19199788-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19199788-02Size:50 mg
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Description
PIK-C98 is a potent and selective PI3K inhibitor demonstrating significant anti-myeloma activity in preclinical studies. It is a valuable research tool for investigating PI3K signaling in hematological malignancies, with utility in both in vitro cell-based assays and in vivo xenograft models for multiple myeloma research.
CAS Number
691388-62-2
Field of Research
Cell Biology, Signal Transduction
Smiles
ClC1=C (C=2OC (C=CC=C (C (N) =S) C#N) =CC2) C=C (Cl) C=C1
Molecular Formula
C16H10Cl2N2OS
Molecular Weight
349.23
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(2E,4E)-2-cyano-5-[5-(2,5-dichlorophenyl)furan-2-yl]penta-2,4-dienethioamide
CAS Number691388-62-2
PubChem CID699147
IUPAC Name(2E,4E)-2-cyano-5-[5-(2,5-dichlorophenyl)furan-2-yl]penta-2,4-dienethioamide
Molecular FormulaC16H10Cl2N2OS
Molecular Weight349.2
XLogP4.4
Topological Polar Surface Area95
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity525
SMILES
C1=CC(=C(C=C1Cl)C2=CC=C(O2)/C=C/C=C(\C#N)/C(=S)N)Cl
InChI
InChI=1S/C16H10Cl2N2OS/c17-11-4-6-14(18)13(8-11)15-7-5-12(21-15)3-1-2-10(9-19)16(20)22/h1-8H,(H2,20,22)/b3-1+,10-2+
InChIKey
CGTZIMSTGBXOIG-IGAJHJTCSA-N
Chemical Structure
2D Structure
2D structure of (2E,4E)-2-cyano-5-[5-(2,5-dichlorophenyl)furan-2-yl]penta-2,4-dienethioamide
CAS: 691388-62-2
CID: 699147
Formula: C16H10Cl2N2OS
MW: 349.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight349.2
XLogP34.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass347.9890895
Monoisotopic Mass347.9890895
Topological Polar Surface Area95 Ų
Heavy Atom Count22
Formal Charge0
Complexity525
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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