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Aurora A/PKC-IN-1

CAT: 0013-GTR19185626-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19185626-01Size:25 mg
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Description
Aurora A/PKC-IN-1 (Compound 2e) is a potent dual inhibitor of Aurora A and PKC isoforms, demonstrating low nanomolar IC50 values. It exhibits anti-proliferative and anti-metastatic activity in breast cancer cell studies, making it a valuable chemical probe for oncology research, particularly in studying kinase signaling pathways in vitro.
CAS Number
2143100-98-3
Field of Research
Cell Biology, Epigenetics & Chromatin, Signal Transduction
Smiles
O=C1N ([Se]C=2C1=CC=CC2) C3=NC (NC4CC[Se]C4) =C5C (=N3) N=CN5
Molecular Formula
C16H14N6OSe2
Molecular Weight
464.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Aurora A/PKC-IN-1
CAS Number2143100-98-3
PubChem CID141656153
IUPAC Name2-[6-(selenolan-3-ylamino)-7H-purin-2-yl]-1,2-benzoselenazol-3-one
Molecular FormulaC16H14N6OSe2
Molecular Weight464.3
Topological Polar Surface Area86.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity525
SMILES
C1C[Se]CC1NC2=NC(=NC3=C2NC=N3)N4C(=O)C5=CC=CC=C5[Se]4
InChI
InChI=1S/C16H14N6OSe2/c23-15-10-3-1-2-4-11(10)25-22(15)16-20-13-12(17-8-18-13)14(21-16)19-9-5-6-24-7-9/h1-4,8-9H,5-7H2,(H2,17,18,19,20,21)
InChIKey
JKTIMGKTTJTCFS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Aurora A/PKC-IN-1
CAS: 2143100-98-3
CID: 141656153
Formula: C16H14N6OSe2
MW: 464.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight464.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass465.95595
Monoisotopic Mass465.95595
Topological Polar Surface Area86.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity525
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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GTR19205108-01PKC-IN-1
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Alternative Products

CatalogName
HY-144307Aurora A/PKC-IN-1
HY-167114(Rac) -Aurora A/PKC-IN-1
HY-115932Aurora kinase-IN-1
MBS5806106Aurora A Inhibitor 1
HY-W231513-01MASTL/Aurora A-IN-1
HY-168440-01Aurora-A ligand 1
144214AURKA (Aurora 2, Aurora family kinase 1, Aurora/IPL1-related kinase 1)
T10412-01Aurora inhibitor 1
HY-179374Aurora kinase/HDAC-IN-1
HY-U00304-01Aurora B inhibitor 1

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