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726169-73-9

Q: What is the CAS number for N-(2-Aminophenyl)-4-([[4-(pyridin-3-yl)pyrimidin-2-yl]amino]methyl)benzamide?

The CAS number of N-(2-Aminophenyl)-4-([[4-(pyridin-3-yl)pyrimidin-2-yl]amino]methyl)benzamide is 726169-73-9.

Q: What is N-(2-Aminophenyl)-4-([[4-(pyridin-3-yl)pyrimidin-2-yl]amino]methyl)benzamide (726169-73-9) used for?

Mocetinostat (726169-73-9) is a class I, isoform-selective HDAC inhibitor, IC50s=0.15, 0.29, 1.66 and 0.59 μM for HDAC1, 2, 3 and 11 respectively.1 Induces hyperacetylation of histones, induces expression of the tumor suppressor p21WAF1 and inhibits proliferation of human cancer cells.2 Mocetinostat displays antifibrotic effects in ischemic heart failure.3 Attenuates the development of hypersensitivity in models of neuropathic pain.4 Active in vivo.5InChI:InChI=1/C23H20N6O/c24-19-5-1-2-6-21(19)28-22(30)17-9-7-16(8-10-17)14-27-23-26-13-11-20(29-23)18-4-3-12-25-15-18/h1-13,15H,14,24H2,(H,28,30)(H,26,27,29)

Product Name:Mocetinostat
Molecular Formula:C₂₃H₂₀N₆O
Molecular Weight:396.451

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Product Details

pd_meltingpoint:>170oC (dec.)

Purity:99%

Cost-effective and customizable Mocetinostat 726169-73-9 for sale

Molecular Formula:C23H20N6O
Molecular Weight:396.451
Melting Point:>170oC (dec.)
PKA:13.13±0.70(Predicted)
PSA：105.82000
Density:1.341g/cm³
LogP:4.71240

N-(2-Aminophenyl)-4-([[4-(pyridin-3-yl)pyrimidin-2-yl]amino]methyl)benzamide(Cas 726169-73-9) Usage

InChI:InChI=1/C23H20N6O/c24-19-5-1-2-6-21(19)28-22(30)17-9-7-16(8-10-17)14-27-23-26-13-11-20(29-23)18-4-3-12-25-15-18/h1-13,15H,14,24H2,(H,28,30)(H,26,27,29)

726169-73-9 Relevant articles

PROCESS FOR THE PREPARATION OF SUBSTITUTED PYRIMIDINES

-

Paragraph 0274; 0275, (2015/02/02)

This invention relates to an improved pr...

Discovery of potent, isoform-selective inhibitors of histone deacetylase containing chiral heterocyclic capping groups and a N-(2-aminophenyl)benzamide binding unit

Marson, Charles M.,Matthews, Christopher J.,Yiannaki, Elena,Atkinson, Stephen J.,Soden, Peter E.,Shukla, Lena,Lamadema, Nermina,Thomas, N. Shaun B.

, p. 6156 - 6174 (2013/09/02)

The synthesis of a novel series of poten...

Discovery of N-(2-Aminophenyl)-4-[(4-pyridin-3-ylpyrimidin-2-ylamino) methyl]benzamide(MGCD0103), an orally active histone deacetylase inhibitor

Zhou, Nancy,Moradei, Oscar,Raeppel, Stephane,Leit, Silvana,Frechette, Sylvie,Gaudette, Frederic,Paquin, Isabelle,Bernstein, Naomy,Bouchain, Giliane,Vaisburg, Arkadii,Jin, Zhiyun,Gillespie, Jeff,Wang, James,Fournel, Marielle,Yan, Pu T.,Trachy-Bourget, Marie-Claude,Kalita, Ann,Lu, Aihua,Rahil, Jubrail,MacLeod, A. Robert,Li, Zuomei,Besterman, Jeffrey M.,Delorme, Daniel

scheme or table, p. 4072 - 4075 (2009/05/27)

The design, synthesis, and biological ev...

Inhibitors of histone deacetylase

-

, (2008/06/13)

The invention relates to the inhibition ...

726169-73-9 Process route

: 849235-68-3
4-(([4-(pyridin-3-yl)pyrimidin-2-yl]amino)methyl)benzoic acid

: 95-54-5
1,2-diamino-benzene

: 726169-73-9
mocetinostat

Conditions

Conditions	Yield
With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In dimethyl sulfoxide; at 20 ℃; for 20.6h; Solvent;	83%
With (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine; In N,N-dimethyl-formamide;	66%
With (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; In N,N-dimethyl-formamide; at 20 ℃; for 24h;

: 849235-67-2
methyl 4-(((4-(pyridin-3-yl)pyrimidin-2-yl)amino)methyl)benzoate

: 726169-73-9
mocetinostat

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: lithium hydroxide; water / 24 h / 20 °C 2: (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate / N,N-dimethyl-formamide / 24 h / 20 °C With water; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; lithium hydroxide; In N,N-dimethyl-formamide;

726169-73-9 Upstream products

849235-68-3
4-(([4-(pyridin-3-yl)pyrimidin-2-yl]amino)methyl)benzoic acid
95-54-5
1,2-diamino-benzene
849235-67-2
methyl 4-(((4-(pyridin-3-yl)pyrimidin-2-yl)amino)methyl)benzoate
736080-30-1
4-guanidinomethylbenzoic acid methyl ester

726169-73-9 Downstream products

944537-89-7
N-(2-aminophenyl)-4-((4-(pyridin-3-yl)pyrimidin-2-ylamino)methyl)benzamide dihydrobromide

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