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AT7867 hydrochloride

CAT: 0931-T84881-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T84881-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2624336-89-4
Target
Others, Akt
Related Pathways
PI3K/Akt/mTOR signaling, Cytoskeletal Signaling, Others
Bioactivity
AT7867 hydrochloride is a potent inhibitor of AKT and p70 S6 kinase, displaying oral activity and demonstrating an anticancer effect [1].
Smiles
ClC1=CC=C(C2(CCNCC2)C3=CC=C(C=C3)C=4C=NNC4)C=C1.Cl
Molecular Formula
C20H21Cl2N3
Molecular Weight
374.31
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

AT7867 (hydrochloride)
CAS Number2624336-89-4
PubChem CID154828682
IUPAC Name4-(4-chlorophenyl)-4-[4-(1H-pyrazol-4-yl)phenyl]piperidine;hydrochloride
Molecular FormulaC20H21Cl2N3
Molecular Weight374.3
Topological Polar Surface Area40.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity394
SMILES
C1CNCCC1(C2=CC=C(C=C2)C3=CNN=C3)C4=CC=C(C=C4)Cl.Cl
InChI
InChI=1S/C20H20ClN3.ClH/c21-19-7-5-18(6-8-19)20(9-11-22-12-10-20)17-3-1-15(2-4-17)16-13-23-24-14-16;/h1-8,13-14,22H,9-12H2,(H,23,24);1H
InChIKey
YZMRULKVIVBSAA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AT7867 (hydrochloride)
CAS: 2624336-89-4
CID: 154828682
Formula: C20H21Cl2N3
MW: 374.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight374.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass373.1112531
Monoisotopic Mass373.1112531
Topological Polar Surface Area40.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity394
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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