ChemicalBook--->CAS DataBase List--->1220699-06-8

1220699-06-8

1220699-06-8 Structure

1220699-06-8 Structure
IdentificationBack Directory
[Name]

PF-04979064
[CAS]

1220699-06-8
[Synonyms]

CS-2664
PF-04979064
PF-04979064 ≥95%
PF 04979064;PF04979064
PF-04979064 >=98% (HPLC)
(S)-1-(1-(2-hydroxypropanoyl)piperidin-4-yl)-3-methyl-8-(6-methylpyridin-3-yl)-1H-imidazo[4,5-c][1,5]naphthyridin-2(3H)-one
1,3-Dihydro-1-[1-[(2S)-2-hydroxy-1-oxopropyl]-4-piperidinyl]-3-methyl-8-(6-methyl-3-pyridinyl)-2H-imidazo[4,5-c][1,5]naphthyridin-2-one
2H-Imidazo[4,5-c][1,5]naphthyridin-2-one, 1,3-dihydro-1-[1-[(2S)-2-hydroxy-1-oxopropyl]-4-piperidinyl]-3-methyl-8-(6-methyl-3-pyridinyl)-
[Molecular Formula]

C24H26N6O3
[MOL File]

1220699-06-8.mol
[Molecular Weight]

446.5
Chemical PropertiesBack Directory
[Boiling point ]

682.0±55.0 °C(Predicted)
[density ]

1.355±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 11 mg/mL (24.64 mM)
[form ]

Solid
[pka]

13.95±0.20(Predicted)
[color ]

White to yellow
[InChIKey]

GACQNUHFDBEIQH-HNNXBMFYSA-N
[SMILES]

CN(C(N1C2CCN(C([C@@H](O)C)=O)CC2)=O)C3=C1C4=NC(C5=CN=C(C)C=C5)=CC=C4N=C3
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319
[Precautionary statements ]

P261-P305+P351+P338
[WGK Germany ]

WGK 3
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Hazard InformationBack Directory
[Uses]

PF-04979064 is a potent and selective PI3K/mTOR dual kinase inhibitor with Kis of 0.13 nM and 1.42 nM for PI3Kα and mTOR, respectively.
[Biological Activity]

PF-04979064 is an orally availablepotent and selective PI3K/mTOR dual kinase inhibitor th at potently inhibits tumor growth in mouse xenografts.
[in vivo]

PF-04979064 is progressed to rat in vivo PK studies and exhibits robust PK profile: Vdss=5.23 L/kg, Cl=19.3 mL/min/kg, T1/2=1.85 h, and F%=61%[1].

[IC 50]

PI3Kα: 0.13 nM (Ki); PI3Kγ: 0.111 nM (Ki); PI3Kδ: 0.122 nM (Ki); mTOR: 1.42 nM (Ki)
[storage]

Store at -20°C
[References]

[1] Cheng H et al. Discovery of the Highly Potent PI3K/mTOR Dual Inhibitor PF-04979064 through Structure-Based Drug Design. ACS Med Chem Lett, 2012 Nov 7, 4(1):91-7. DOI:10.1021/ml300309h
Spectrum DetailBack Directory
[Spectrum Detail]

PF-04979064(1220699-06-8)1HNMR
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