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1-BOC-4-CYANOMETHYL PIPERAZINE is a chemical compound with the molecular formula C11H18N4O2, belonging to the class of heterocyclic amines. It is a derivative of piperazine, featuring a BOC (tert-butoxycarbonyl) protective group and a cyanomethyl functional group. 1-BOC-4-CYANOMETHYL PIPERAZINE is widely used in organic synthesis and pharmaceutical research, serving as a building block for the development of various pharmaceuticals, including antiviral and anticancer agents. Its versatility extends to the production of agrochemicals and other fine chemicals, and it is recognized for its potential as a reactive intermediate in organic reactions, making it an essential tool in chemical synthesis.

77290-31-4

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77290-31-4 Usage

Uses

Used in Pharmaceutical Research and Development:
1-BOC-4-CYANOMETHYL PIPERAZINE is used as a key intermediate in the synthesis of pharmaceuticals for its ability to form various active compounds with potential therapeutic applications. Its presence in the molecular structure of these compounds contributes to their biological activity, making it a valuable component in drug discovery and development.
Used in Organic Synthesis:
In the field of organic synthesis, 1-BOC-4-CYANOMETHYL PIPERAZINE is employed as a versatile building block for creating a range of organic compounds. Its BOC protective group and cyanomethyl functional group allow for selective reactions and the formation of diverse chemical entities, facilitating the synthesis of complex organic molecules.
Used in Agrochemical Production:
1-BOC-4-CYANOMETHYL PIPERAZINE is utilized in the production of agrochemicals, where it serves as a precursor to develop compounds with pesticidal or herbicidal properties. Its incorporation into these products enhances their effectiveness in agricultural applications, contributing to crop protection and yield improvement.
Used in Fine Chemicals Industry:
In the fine chemicals industry, 1-BOC-4-CYANOMETHYL PIPERAZINE is used as a starting material for the synthesis of specialty chemicals with specific applications in various sectors, such as fragrances, dyes, and advanced materials. Its unique structural features enable the creation of high-value products with tailored properties.
Used as a Reactive Intermediate in Organic Reactions:
1-BOC-4-CYANOMETHYL PIPERAZINE is recognized for its potential as a reactive intermediate in organic reactions, allowing for the formation of new chemical bonds and the synthesis of novel compounds. Its reactivity makes it an important tool for chemists in the development of innovative synthetic routes and the exploration of new chemical space.

Check Digit Verification of cas no

The CAS Registry Mumber 77290-31-4 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,7,2,9 and 0 respectively; the second part has 2 digits, 3 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 77290-31:
(7*7)+(6*7)+(5*2)+(4*9)+(3*0)+(2*3)+(1*1)=144
144 % 10 = 4
So 77290-31-4 is a valid CAS Registry Number.
InChI:InChI=1/C11H19N3O2/c1-11(2,3)16-10(15)14-8-6-13(5-4-12)7-9-14/h5-9H2,1-3H3

77290-31-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name tert-butyl 4-(cyanomethyl)piperazine-1-carboxylate

1.2 Other means of identification

Product number -
Other names 4-Cyanomethyl-piperazine-1-carboxylic acid tert-butyl ester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:77290-31-4 SDS

77290-31-4Relevant academic research and scientific papers

Design, synthesis and biological evaluation of marine phidianidine-inspired derivatives against oxidized LDL-induced endothelial injury by activating Nrf2 anti-oxidation pathway

Xie, Hong-Xu,Wang, Yan-Hong,Zhang, Jin-He,Zhang, Juan,Zhong, Ying-Nan,Ge, Yong-Xi,Cheng, Zhi-Qiang,Jiang, Cheng-Shi,Meng, Ning

, (2022/01/20)

Inhibition of oxidized low-density lipoprotein (oxLDL)-induced vascular endothelial cell (VEC) injury is one of the effective strategies for treating atherosclerosis. In the present study, a series of novel marine phidianidine-inspired indole-1,2,4-oxadiazoles was designed, synthesized, and evaluated for their effects against oxLDL-induced injury in VECs. Among them, compound D-6, displaying the most effective protective activity, was found to inhibit oxLDL-induced apoptosis and the expression of ICAM-1 and VCAM-1 in VECs. Mechanistic studies showed that D-6 could trigger Nrf2 nuclear translocation, subsequently resulting in increased expression of Nrf2 target gene HO-1. Meanwhile, D-6 suppressed the increase of ROS level and nuclear translocation of NF-κB induced by oxLDL. Importantly, Nrf2 knockdown attenuated the inhibition effects of D-6 on oxLDL-induced apoptosis, ROS production and NF-κB nuclear translocation. Collectively, our studies demonstrated that compound D-6 protected against oxLDL-induced endothelial injury by activating Nrf2/HO-1 anti-oxidation pathway.

Synthesis and application of indole oxadiazole derivative with aryl piperazine structure

-

Paragraph 0022-0023, (2021/08/06)

The invention relates to the field of medicinal chemistry, in particular to an indole-1, 2, 4 oxadiazole derivative with an aryl piperazine structure which has a protective effect on oxLDL-induced endothelial dysfunction cells. The structural general formula of the derivative is shown in the specification. A preliminary activity test proves that the compound has a protective effect on the oxLDL-induced endothelial dysfunction cells. The compound provided by the invention is simple in structure, has a strong protection effect on oxLDL-induced endothelial dysfunction cells, and provides guidance for research and development of novel anti-atherosclerosis drugs.

Preparation and application of indole oxadiazole derivative with acylated piperazine structure

-

Paragraph 0022-0023, (2021/08/07)

The invention relates to the field of medicinal chemistry, in particular to an indole-1, 2, 4 oxadiazole derivative containing an acylated piperazine structure, which has a protective effect on oxLDL-induced endothelial dysfunction cells, the structural general formula of the indole-1, 2, 4 oxadiazole derivative is shown in the specification, and a preliminary activity test proves that the compound has the protective effect on the oxLDL-induced endothelial dysfunction cells. The compound provided by the invention is simple in structure, has a strong protection effect on oxLDL-induced endothelial dysfunction cells, and provides guidance for research and development of novel anti-atherosclerosis drugs.

AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CONDITIONS RELATED TO THE MODULATION OF IL-12, IL-23 AND/OR IFN-ALPHA

-

Page/Page column 93, (2020/05/29)

Compounds having the following formula I: or a stereoisomer or pharmaceutically-acceptable salt thereof, where R1, R2, R3, R4, and R5 are as defined herein, are useful in the modulation of IL-12, IL-2

Design, synthesis, and evaluation of the anticancer properties of a novel series of carboxamides, sulfonamides, ureas, and thioureas derived from 1,2,4-oxadiazol-3-ylmethyl-piperazin-1-yl substituted with pyrazolo[1,5-a]pyrimidine derivatives

Ajeesh Kumar,Nair, Kanya B.,Bodke, Yadav D.,Sambasivam, Ganesh,Bhat, Kishore G.

, p. 2221 - 2234 (2016/11/17)

Abstract: A series of novel carboxamides, sulfonamides, ureas, and thioureas derived from 1,2,4-oxadiazol-3-ylmethyl-piperazin-1-yl substituted with pyrazolo[1,5-a]pyrimidine analog were designed and synthesized. The newly synthesized compounds were characterized by 1H NMR, 13C NMR, ESI–MS, and IR and were tested for their in vitro antiproliferative activity by MTT assay. Out of these twenty derivatives, five compounds showed good anticancer activity against HeLa cell line. These are superior with less than 10?μg/cm3 of IC50 when compared to the marketed anticancer drug paclitaxel with 30?μg/cm3 of IC50 against Hela cell line. Graphical abstract: [Figure not available: see fulltext.]

NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS

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Page/Page column 58, (2012/02/05)

The present invention provides compounds of Formula (I), pharmaceutical compositions thereof, and methods of using the same in the treatment or prevention of diseases mediated by the activation of β3-adrenoceptor. (I).

Isoindolone formation via intramolecular Diels-Alder reaction

Ball, Matthew,Boyd, Alistair,Churchill, Gwydion,Cuthbert, Murray,Drew, Mark,Fielding, Mark,Ford, Gair,Frodsham, Lianne,Golden, Michael,Leslie, Kevin,Lyons, Sarah,McKeever-Abbas, Ben,Stark, Andrew,Tomlin, Paula,Gottschling, Stephen,Hajar, Abraham,Jiang, Ji-Long,Lo, Josephine,Suchozak, Bob

experimental part, p. 741 - 747 (2012/07/31)

The intramolecular Diels-Alder reaction provides a useful synthetic methodology to build biologically active and synthetically useful isoindolone ring systems. An application of this methodology, providing an efficient manufacturing route to an mGluR2 positive allosteric modulator via a 1,5,7-substituted isoindolone, is reported herein.

DIKETO-PIPERAZINE AND PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS

-

Page/Page column 132, (2008/06/13)

This disclosure provides compounds having drug and bio-affecting properties, their pharmaceutical compositions and method of use. In particular, the disclosure is concerned with diketo piperazine and piperadine derivatives that possess unique antiviral activity. More particularly, the present disclosure relates to compounds useful for the treatment of HIV and AIDS.

Design and synthesis of tetracyclic nonpeptidic biaryl nitrile inhibitors of cathepsin K

Setti, Eduardo L.,Venkatraman, Shankar,Palmer, James T.,Xie, Xiaoming,Cheung, Harry,Yu, Walter,Wesolowski, Gregg,Robichaud, Joel

, p. 4296 - 4299 (2008/02/03)

The synthesis and biological profile of a novel series of potent and selective inhibitors of cysteine protease cathepsin K (Cat K) are described. Pharmacokinetic evaluation of 12 indicated that some members of this series could be suitable candidates to develop new orally active therapeutic agents for the treatment of osteoporosis.

Quinazoline derivatives with anti-tumour activity

-

, (2008/06/13)

The invention concerns quinazoline derivatives of Formula I wherein each of m, R1, n, R2 and R3 have any of the meanings defined in the description; processes for their preparation, pharmaceutical compositions containing them and their use in the manufacture of a medicament for use as an anti-invasive agent in the containment and/or treatment of solid tumour disease.

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