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LAQ824

CAT: 0013-GTR19162267-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19162267-07Size:100 mg
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Description
LAQ824 (Dacinostat) is a novel HDAC inhibitor with IC50 of 32 nM and is known to activate the p21 promoter. (In Vitro) :Dacinostat (NVP-LAQ824) activates p21 promoter, with AC50 of 0.30 μM. NVP-LAQ824 inhibits tumor cell (H1299, HCT116) growth, with IC50s of 150 and 10 nM, respectively. NVP-LAQ824 also shows inhibitory activities against two prostate cancer cell lines (DU145 and PC3) and a breast cancer line (MDA435), with IC50s of 18, 23, 39 nM, respectively. Continuous exposure of NVP-LAQ824 for 72 h produces LD90s of 0.09 M in HCT116 cells and 0.47 M in A549 cells. NVP-LAQ824 treatment of NDHF cells causes the expected G1-S growth arrest in addition to a significant reduction of cells in S-phase and accumulation of cells at the G2-M checkpoint. NVP-LAQ824 induces apoptotic death in human tumor cells. NPV-LAQ824 increases acetylation of histones H3 and H4. Dacinostat inhibits HDAC1 with an IC50 of 9 nM. Dacinostat (10 and 20 nM) suppresses proliferation of AML fusion protein-expressing 32D cells. Dacinostat impairs short-term engraftment potential of leukemic stem cells. Dacinostat exhausts in vitro self-renewal potential of murine AML1/ETO- and PLZF/RARα-positive HSC. (In Vivo) :NVP-LAQ824 produces a dose-dependent inhibition of tumor growth, and at 100 mg/kg, its antitumor effect is similar to that of 5-Fluorouracil.
CAS Number
404951-53-7
Product Name Alternative
Dacinostat
Purity
>98% (HPLC)
Solubility
DMSO: 76 mg/mL (200.28 mM)
Smiles
O=C (NO) /C=C/C1=CC=C (CN (CCO) CCC2=CNC3=C2C=CC=C3) C=C1
Molecular Formula
C22H25N3O3
Molecular Weight
379.46
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
(2E) -N-hydroxy-3-[4-[[ (2-hydroxyethyl) [2- (1H-indol-3-yl) ethyl]amino]methyl]phenyl]-2-propenamide

Chemical Information

Dacinostat

N-hydroxy-3-[4-[[2-hydroxyethyl-[2-(1H-indol-3-yl)ethyl]amino]methyl]phenyl]-2-propenamide is a member of tryptamines.

CAS Number404951-53-7
PubChem CID6445533
IUPAC Name(E)-N-hydroxy-3-[4-[[2-hydroxyethyl-[2-(1H-indol-3-yl)ethyl]amino]methyl]phenyl]prop-2-enamide
Molecular FormulaC22H25N3O3
Molecular Weight379.5
XLogP2.6
Topological Polar Surface Area88.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Heavy Atom Count28
Formal Charge0
Complexity505
SMILES
C1=CC=C2C(=C1)C(=CN2)CCN(CCO)CC3=CC=C(C=C3)/C=C/C(=O)NO
InChI
InChI=1S/C22H25N3O3/c26-14-13-25(12-11-19-15-23-21-4-2-1-3-20(19)21)16-18-7-5-17(6-8-18)9-10-22(27)24-28/h1-10,15,23,26,28H,11-14,16H2,(H,24,27)/b10-9+
InChIKey
BWDQBBCUWLSASG-MDZDMXLPSA-N
Chemical Structure
2D Structure
2D structure of Dacinostat
CAS: 404951-53-7
CID: 6445533
Formula: C22H25N3O3
MW: 379.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight379.5
XLogP32.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass379.18959167
Monoisotopic Mass379.18959167
Topological Polar Surface Area88.6 Ų
Heavy Atom Count28
Formal Charge0
Complexity505
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
MBS8506194-01LAQ824 (NVP-LAQ824)
A4103-5.1LAQ824 (NVP-LAQ824,Dacinostat)
MBS385847-01LAQ824 (NVP-LAQ824, Dacinostat)
2634-5LAQ824
A10516-1LAQ824 (NVP-LAQ824, Dacinostat) 1mg
A10516-500LAQ824 (NVP-LAQ824, Dacinostat) 500mg
A10516-25LAQ824 (NVP-LAQ824, Dacinostat) 25mg
A10516-5LAQ824 (NVP-LAQ824, Dacinostat) 5mg
A10516-2LAQ824 (NVP-LAQ824, Dacinostat) 2mg
MBS130121-01NVP-LAQ824

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