I-CBP112 (hydrochloride)

I-CBP112 is an inhibitor of p300 and CREB-binding protein (CBP) histone acetyltransferases. It binds to the p300 and CBP bromodomains (Kds = 167 and 151 nM, respectively) and is selective for p300 and CBP over BRD4, as well as a panel of 104 nuclear receptors and ion channels and a panel of 32 enzymes at 10 µM. I-CBP112 displaces acetylated histones from CBP in a cell-free assay (IC50 = 170 nM). It reduces colony formation and increases differentiation of primary murine leukemic blasts and delays disease initiation following leukemic blast transplantation into sub-lethally irradiated mice when used at concentrations of 5 and 10 µM.Formal Name: 1-[7-(3,4-dimethoxyphenyl)-2,3-dihydro-9-[[(3S)-1-methyl-3-piperidinyl]methoxy]-1,4-benzoxazepin-4(5H)-yl]-1-propanone, monohydrochloride. CAS Number: 2147701-33-3. Molecular Formula: C27H36N2O5 . HCl. Formula Weight: 505.1. Purity: >90%. Formulation: (Request formulation change), A crystalline solid. Solubility: DMF: 16 mg/ml, DMSO: 16 mg/ml, Ethanol: 16 mg/ml, PBS (pH 7.2): 10 mg/ml. lambdamax: 213, 269, 291 nm. SMILES: COC1=C(OC)C=C(C2=CC(OC[C@H]3CCCN(C)C3)=C(OCCN(C(CC)=O)C4)C4=C2)C=C1.Cl. InChi Code: InChI=1S/C27H36N2O5.ClH/c1-5-26(30)29-11-12-33-27-22(17-29)13-21(20-8-9-23(31-3)24(14-20)32-4)15-25(27)34-18-19-7-6-10-28(2)16-19,/h8-9,13-15,19H,5-7,10-12,16-18H2,1-4H3,1H/t19-,/m0./s1. InChi Key: NZYYXGVOYOZTHZ-FYZYNONXSA-N.