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Imofinostat

CAT: 0013-GTR19204301-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204301-01Size:1 mg
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Description
Imofinostat (MPT0E028) is an orally bioavailable pan-HDAC inhibitor, showing potent activity against HDAC1, HDAC2, and HDAC6. It exhibits anticancer effects in B-cell lymphoma and other tumors by inducing cell cycle arrest, apoptosis, and inhibiting Akt signaling in vitro and in vivo.
CAS Number
1338320-94-7
Product Name Alternative
Akt, ABT301, ABT-301, MPT0E 028, MPT0E028, MPT-0E028, MPT0E-028, HDAC6, HDAC8, HDAC1, HDAC2, TMUC0012, TMU-C-0012
Field of Research
Cell Biology, Epigenetics & Chromatin, Molecular Biology, Signal Transduction
Purity
99.24% (May vary between batches)
Solubility
DMSO:80 mg/mL (232.3 mM) ;10% DMSO+40% PEG300+5% Tween-80+45% Saline:3.3 mg/mL (9.58 mM)
Smiles
ONC (=O) \C=C\c1ccc2N (CCc2c1) S (=O) (=O) c1ccccc1
Molecular Formula
C17H16N2O4S
Molecular Weight
344.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-(1-(Benzenesulfonyl)-2,3-dihydro-1H-indol-5-yl)-N-hydroxyacrylamide

Imofinostat is an orally bioavailable N-hydroxyacrylamide-derived inhibitor of both human pan-histone deacetylase (HDAC) enzymes and the serine/threonine protein kinase Akt (protein kinase B), with potential antineoplastic activity. Upon administration, imofinostat selectively binds to and inhibits HDACs, which inhibits deacetylation of histone proteins and leads to the accumulation of highly acetylated histones. This may result in both an induction of chromatin remodeling, and the selective transcription of tumor suppressor genes. This prevents cell division and induces both cell cycle arrest and apoptosis, which may inhibit the proliferation of susceptible tumor cells. In addition, imofinostat inhibits the phosphorylation and activation of Akt, which prevents the activation of downstream signaling pathways, independent of its HDAC inhibitory activity. HDACs, upregulated in many tumor cell types, are a family of enzymes that deacetylate histone proteins. Akt, overexpressed in many tumor cell types, plays a key role in tumor cell proliferation and survival.

CAS Number1338320-94-7
PubChem CID53464642
IUPAC Name(E)-3-[1-(benzenesulfonyl)-2,3-dihydroindol-5-yl]-N-hydroxyprop-2-enamide
Molecular FormulaC17H16N2O4S
Molecular Weight344.4
XLogP1.9
Topological Polar Surface Area95.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity578
SMILES
C1CN(C2=C1C=C(C=C2)/C=C/C(=O)NO)S(=O)(=O)C3=CC=CC=C3
InChI
InChI=1S/C17H16N2O4S/c20-17(18-21)9-7-13-6-8-16-14(12-13)10-11-19(16)24(22,23)15-4-2-1-3-5-15/h1-9,12,21H,10-11H2,(H,18,20)/b9-7+
InChIKey
MGTIFSBCGGAZDB-VQHVLOKHSA-N
Chemical Structure
2D Structure
2D structure of 3-(1-(Benzenesulfonyl)-2,3-dihydro-1H-indol-5-yl)-N-hydroxyacrylamide
CAS: 1338320-94-7
CID: 53464642
Formula: C17H16N2O4S
MW: 344.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight344.4
XLogP31.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass344.08307817
Monoisotopic Mass344.08307817
Topological Polar Surface Area95.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity578
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-124295-01Imofinostat
A18982-50Imofinostat (MPT0E028) 50mg
A18982-10Imofinostat (MPT0E028) 10mg
A18982-100Imofinostat (MPT0E028) 100mg
A18982-25Imofinostat (MPT0E028) 25mg
A18982-5Imofinostat (MPT0E028) 5mg

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