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MT1 BET inhibitor

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MT1 BET inhibitor Basic information

Product Name:
MT1 BET inhibitor
Synonyms:
  • 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetamide, N,N'-3,6,9,12,15,18,21-heptaoxatricosane-1,23-diylbis[4-(4-chlorophenyl)-2,3,9-trimethyl-, (6S,6'S)-
  • MT1 BET inhibitor
CAS:
2060573-82-0
MF:
C54H66Cl2N10O9S2
MW:
1134.2
Mol File:
2060573-82-0.mol
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MT1 BET inhibitor Chemical Properties

Density 
1.39±0.1 g/cm3(Predicted)
form 
Solid
pka
14.57±0.46(Predicted)
color 
Off-white to light yellow
InChIKey
JNSLBXJNVHYNNW-CXNSMIOJSA-N
SMILES
C(NC(=O)C[C@@H]1N=C(C2=CC=C(Cl)C=C2)C2C(C)=C(C)SC=2N2C(C)=NN=C21)COCCOCCOCCOCCOCCOCCOCCNC(=O)C[C@@H]1N=C(C2=CC=C(Cl)C=C2)C2C(C)=C(C)SC=2N2C(C)=NN=C21
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MT1 BET inhibitor Usage And Synthesis

Uses

MT1 is a bivalent chemical probe of BET bromodomains, with an IC50 of 0.789 nM for BRD4(1)[1].

in vivo

MT1 (44.2 and 22.1 μmol/kg, ip daily, for 14 days) significantly delayed leukemia progression in mice (Mus musculus) compared to JQ1[1].
MT1 exhibits terminal t1/2 of 2.70 h in mice[1].

Animal Model:Leukemia xenograft models[1].
Dosage:44.2 and 22.1 μmol/kg.
Administration:Intraperitoneally for 14 subsequent days.
Result:Significantly reduced leukemic burden over the course of the study compared to either vehicle or JQ1.

References

[1] Minoru Tanaka, et al. Design and characterization of bivalent BET inhibitors. Nat Chem Biol. 2016 Dec;12(12):1089-1096. DOI:10.1038/nchembio.2209

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