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1009820-21-6

1009820-21-6 Structure

1009820-21-6 Structure
IdentificationBack Directory
[Name]

5-[(3-chlorophenyl)amino]-Benzo[c]-2,6-naphthyridine-8-carboxylic acid
[CAS]

1009820-21-6
[Synonyms]

CX-4945
CS-1985
Silmitasertib
CX-4945, >=98%
CX-4945, CX4945
mitasertib (CX-4945)
Silmitasertib(CX-4945)
CX-4945 Silmitasertib
SILMITASERTIB; CX 4945; CX4945
CX-4945 (SILMITASERTIB);CX 4945; CX4945
CX4945 CX-4945; CX 4945; SILMITASERTIB.
5-[(3-chlorophenyl)amino]-Benzo[c]-2,6-naphthyridine-8-carboxylic acid
Silmitasertib, 98%, a potent and selective ATP-competitive CK2 inhibitor
Benzo[c]-2,6-naphthyridine-8-carboxylic acid, 5-[(3-chlorophenyl)amino]-
5-[(3-Chlorophenyl)amino]benzo[c]-2,6-naphthyridine-8-carboxylic acid CX-4945 (Silmitasertib)
[Molecular Formula]

C19H12ClN3O2
[MDL Number]

MFCD13184796
[MOL File]

1009820-21-6.mol
[Molecular Weight]

349.77
Chemical PropertiesBack Directory
[Boiling point ]

568.5±50.0 °C(Predicted)
[density ]

1.490
[storage temp. ]

Store at -20°C
[solubility ]

≥103.5 mg/mL in DMSO; insoluble in H2O; insoluble in EtOH
[form ]

Orange powder.
[pka]

2.96±0.30(Predicted)
[color ]

Yellow to orange
[InChI]

InChI=1S/C19H12ClN3O2/c20-12-2-1-3-13(9-12)22-18-15-6-7-21-10-16(15)14-5-4-11(19(24)25)8-17(14)23-18/h1-10H,(H,22,23)(H,24,25)
[InChIKey]

MUOKSQABCJCOPU-UHFFFAOYSA-N
[SMILES]

C1(NC2=CC=CC(Cl)=C2)C2=C(C=NC=C2)C2=CC=C(C(O)=O)C=C2N=1
Safety DataBack Directory
[HS Code ]

29339900
Hazard InformationBack Directory
[Uses]

CX-4945 is a protein kinase CK2 inhibitor resulting in cancer cell death and prevention of proliferation. Anti-leukemia agent.
[Biological Activity]

cx-4945 (silmitasertib) is a potent and selective casein kinase 2 (ck2) inhibitor with ic50 value of 1 nm. it is atp-competitive and can be taken orally [1].cx-4945 has been reported to have antiproliferative activity against a wide range of tumor cell lines. it is suggested that cx-4945 suppresses the ck2 regulated pi3k/akt signaling pathway by inhibiting akt phosphorylation at serine 129, but not by activating pten. additionally, cells treated with cx-4945 had a reduction of p21 phophorylation and an up-regulations of total p21 and p27. cx-4945 has been shown to induce cell-cycle arrest at g2/m phase in breast cancer cell line bt-474. it also causes cell-cycle arrest at g1 phase the breast cancer cell line bxpc-3) [1].in cx-4945 and bxpc-3 derived mouse xenograft model, cx-4945 induced a reduction of phos-p21 expression along with anti-carcinoma effects [1]
[in vivo]

Silmitasertib (CX-4945) (25 or 75 mg/kg, p.o.) is well tolerated and demonstrated robust antitumor activity with concomitant reductions of the mechanism-based biomarker phospho-p21 (T145) in murine xenograft models[1].

[IC 50]

CK2α: 1 nM (IC50); CK2α': 1 nM (IC50)
[References]

[1] siddiqui-jain a1, drygin d, streiner n, chua p, pierre f, o'brien se, bliesath j, omori m, huser n, ho c, proffitt c, schwaebe mk, ryckman dm, rice wg,anderes k. cx-4945, an orally bioavailable selective inhibitor of protein kinase ck2, inhibits prosurvival and angiogenic signaling and exhibits antitumor efficacy. cancer res. 2010 dec 15; 70 (24): 10288-98.
Spectrum DetailBack Directory
[Spectrum Detail]

CX-4945(1009820-21-6)1HNMR
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