| Identification | Back Directory | [Name]
ETP46464 | [CAS]
1345675-02-6 | [Synonyms]
ETP46464
73218-79-8
ETP46464 USP/EP/BP
ETP 46464; ETP46464
2-Methyl-2-(4-(2-oxo-9-(quinolin-3-yl)-2,4-dihydro-1H-[1,3]oxazino[5,4-c]quinolin-1-yl)phenyl)
2-methyl-2-[4-(2-oxo-9-quinolin-3-yl-4H-[1,3]oxazino[5,4-c]quinolin-1-yl)phenyl]propanenitrile
Benzeneacetonitrile, α,α-dimethyl-4-[2-oxo-9-(3-quinolinyl)-2H-[1,3]oxazino[5,4-c]quinolin-1(4H)-yl]-
alpha,alpha-Dimethyl-4-[2-oxo-9-(3-quinolinyl)-2H-[1,3]oxazino[5,4-c]quinolin-1(4H)-yl]-benzeneacetonitrile
alpha,alpha-Dimethyl-4-[2-oxo-9-(3-quinolinyl)-2H-[1,3]oxazino[5,4-c]quinolin-1(4H)-yl]-benzeneacetonitrile ETP46464 | [Molecular Formula]
C30H22N4O2 | [MDL Number]
MFCD23160051 | [MOL File]
1345675-02-6.mol | [Molecular Weight]
470.521 |
| Chemical Properties | Back Directory | [Boiling point ]
709.3±60.0 °C(Predicted) | [density ]
1.310±0.06 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
≥16.13 mg/mL in DMSO | [form ]
solid | [pka]
5.10±0.20(Predicted) | [color ]
Light yellow to yellow | [InChI]
1S/C30H22N4O2/c1-30(2,18-31)23-8-10-24(11-9-23)34-28-22(17-36-29(34)35)16-33-27-12-7-19(14-25(27)28)21-13-20-5-3-4-6-26(20)32-15-21/h3-16H,17H2,1-2H3 | [InChIKey]
DPLMXAYKJZOTKO-UHFFFAOYSA-N | [SMILES]
CC(C)(C#N)C(C=C1)=CC=C1N(C2=C(CO3)C=NC(C2=C4)=CC=C4C5=CC6=C(C=CC=C6)N=C5)C3=O |
| Hazard Information | Back Directory | [Uses]
ETP-46464 is used as an ATR inhibitor in the treatment of cancer-associated mutations. | [Biological Activity]
etp-46464 is a potent and selective inhibitor for atr (ic50 = 25 nm).atr (atm- and rad3-related) is a member of pikk (phosphatidylinositol 3-kinase-like kinases) that regulates the dna damage response pathways. it is a dna damage sensor that is activated upon genotoxic stresses (e.g. ionizing radiation, uv radiation and dna replication stalling) and phosphorylates its downstream substrates (e.g. p53, brca1 and chek1).etp-46464 abolished the g2/m checkpoint. it caused the presence of micronuclei or completely fragmented nuclei in cells under ionizing radiation. cells treated simultaneously with hydroxyurea and etp-46464 exhibited elevated atm and chk2 phosphorylation. in u2os cells, etp-46464 promoted the breakage of stalked replication forks. [1] | [target]
mTOR | [IC 50]
mTOR: 0.6 nM (IC50); ATR: 14 nM (IC50); ATM: 545 nM (IC50); DNA-PK: 36 nM (IC50); PI3Kα: 170 nM (IC50) | [References]
1. toledo li, murga m, zur r et al. a cell-based screen identifies atr inhibitors with synthetic lethal properties for cancer-associated mutations. nat struct mol biol. 2011 jun;18(6):721-7. |
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