Description
Key facts
CAS number:2080306-23-4,
Purity:>98%,
Form:SolidSee storage information,
Molecular weight:429.5 Da,
Molecular formula:C25H23N3O4,
PubChem:122705990,
Nature:Synthetic,
Solubility:100 mM in DMSO,
Biochemical name:6-(3-Oxidanylpropyl)-2-(1,3,6-Trimethyl-2-Oxidanylidene-Benzimidazol-5-Yl)benzo[de]isoquinoline-1,3-Dione,
Biological description:Potent and selective bromodomain inhibitor of TAF1 (IC50 = 8-13 nM) and BRD1 (IC50 = 6-67 nM). More than 30-fold selective versus BRD9 and ATAD2. More than 300-fold selective versus BRD4. Inhibits BRD1 (IC50 = 0.58 μM) and TAF1 (IC50 = 0.9 μM) binding to Histone H4 in cell-based assays; also inhibits BRD1 (IC50 = 0.83 μM) and TAF1 (IC50 = 1.4 μM) binding to Histone H3.3.,
Canonical smiles:CC1=CC2=C(C=C1N3C(=O)C4=C5C(=C(C=C4)CCCO)C=CC=C5C3=O)N(C(=O)N2C)C,
InChi:InChI=1S/C25H23N3O4/c1-14-12-20-21(27(3)25(32)26(20)2)13-19(14)28-23(30)17-8-4-7-16-15(6-5-11-29)9-10-18(22(16)17)24(28)31/h4,7-10,12-13,29H,5-6,11H2,1-3H3,
InChiKey:OFWWWKWUCDUISA-UHFFFAOYSA-N,
IUPAC Name:6-(3-hydroxypropyl)-2-(1,3,6-trimethyl-2-oxobenzimidazol-5-yl)benzo[de]isoquinoline-1,3-dione
Properties and Storage Information:
Shipped at conditions-Blue Ice, Appropriate short-term storage conditions--20°C, Appropriate long-term storage conditions--20°C
