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Methyl 4-(4-Boc-1-piperazinyl)-3-chlorobenzoate is a chemical compound characterized by the molecular formula C16H22ClN3O4. It is a derivative of piperazine, a heterocyclic organic compound, and is recognized for its role in the synthesis of pharmaceutical drugs and other organic compounds. This chlorinated ester features a methyl group and a Boc-protected piperazine moiety, which renders it a versatile building block in the production of a variety of pharmaceuticals and agrochemicals. Its potential applications in medicinal chemistry and drug development are attributed to its capacity to alter biological activity and pharmacokinetic properties.

906559-46-4

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906559-46-4 Usage

Uses

Used in Pharmaceutical Industry:
Methyl 4-(4-Boc-1-piperazinyl)-3-chlorobenzoate is used as a key intermediate in the synthesis of various pharmaceuticals for its ability to contribute to the modification of biological activity and pharmacokinetic properties of the final drug products.
Used in Agrochemical Industry:
In the agrochemical sector, Methyl 4-(4-Boc-1-piperazinyl)-3-chlorobenzoate is utilized as a precursor in the development of agrochemicals, leveraging its chemical structure to enhance the effectiveness of these compounds in agricultural applications.
Used in Medicinal Chemistry Research:
Methyl 4-(4-Boc-1-piperazinyl)-3-chlorobenzoate serves as a valuable compound in medicinal chemistry research, where it is employed to explore new drug candidates and understand the structure-activity relationships of potential therapeutic agents.
Used in Drug Development:
Methyl 4-(4-Boc-1-piperazinyl)-3-chlorobenzoate is also used in drug development processes, where its unique structural features allow for the creation of new molecular entities with improved therapeutic profiles, including enhanced efficacy, selectivity, and safety.

Check Digit Verification of cas no

The CAS Registry Mumber 906559-46-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 9,0,6,5,5 and 9 respectively; the second part has 2 digits, 4 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 906559-46:
(8*9)+(7*0)+(6*6)+(5*5)+(4*5)+(3*9)+(2*4)+(1*6)=194
194 % 10 = 4
So 906559-46-4 is a valid CAS Registry Number.

906559-46-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name tert-butyl 4-(2-chloro-4-methoxycarbonylphenyl)piperazine-1-carboxylate

1.2 Other means of identification

Product number -
Other names Methyl4-(4-Boc-1-piperazinyl)-3-chlorobenzoate

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:906559-46-4 SDS

906559-46-4Relevant academic research and scientific papers

POLY-ADP RIBOSE POLYMERASE (PARP) INHIBITORS

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Page/Page column 30; 31, (2018/07/29)

The present invention is related to a pharmaceutical composition comprising a pharmaceutically acceptable carrier or diluent and a compound represented by the following structural formula: The present invention is also related a method of treating a subject with a disease which can be ameliorated by inhibition of poly(ADP-ribose)polymerase (PARP). The definitions of the variables are provided herein.

Mechanisms of action of novel influenza A/M2 viroporin inhibitors derived from hexamethylene amiloride

Jalily, Pouria H.,Eldstrom, Jodene,Miller, Scott C.,Kwan, Daniel C.,Tai, Sheldon S.-H.,Chou, Doug,Niikura, Masahiro,Tietjen, Ian,Fedida, David

supporting information, p. 80 - 95 (2016/07/28)

The increasing prevalence of influenza viruses with resistance to approved antivirals highlights the need for new anti-influenza therapeutics. Here we describe the functional properties of hexamethylene amiloride (HMA)'derived compounds that inhibit the wildtype and adamantane-resistant forms of the influenza A M2 ion channel. For example, 6-(azepan-1-yl)-N-carbamimidoylnicotinamide (9) inhibits amantadine-sensitive M2 currents with 3- to 6-fold greater potency than amantadine or HMA (IC50 5 0.2 vs. 0.6 and 1.3 μM, respectively). Compound 9 competes with amantadine for M2 inhibition, and molecular docking simulations suggest that 9 binds at site(s) that overlap with amantadine binding. In addition, tert-butyl 4′-(carbamimidoylcarbamoyl)-2′,3-dinitro- [1,1′-biphenyl]-4-carboxylate (27) acts both on adamantanesensitive and a resistantM2variant encoding a serine to asparagine 31 mutation (S31N) with improved efficacy over amantadine and HMA (IC5050.6 μMand4.4mM, respectively).Whereas 9 inhibited in vitro replication of influenza virus encoding wild-type M2 (EC505 2.3 μM), both 27 and tert-butyl 4′-(carbamimidoylcarbamoyl)-2′,3- dinitro-[1,1′-biphenyl]-4-carboxylate (26) preferentially inhibited viruses encoding M2(S31N) (respective EC50 5 18.0 and 1.5 μM). This finding indicates thatHMAderivatives can be designed to inhibit viruses with resistance to amantadine. Our study highlights the potential of HMA derivatives as inhibitors of drug-resistant influenza M2 ion channels.

PYRIDYL AND PHENYL SUBSTITUTED PIPERAZINE-PIPERIDINES WITH CXCR3 ANTAGONIST ACTIVITY

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Page/Page column 142-143, (2008/06/13)

The present application discloses a compound, or enantiomers, stereoisomers, rotamers, tautomers, racemates or prodrug of said compound, or pharmaceutically acceptable salts, solvates or esters of said compound, or of said prodrug, said compound having the general structure shown in Formula 1: and the pharmaceutically acceptable salts, solvates and esters thereof. Also disclosed is a method of treating chemokine mediated diseases, such as, palliative therapy, curative therapy, prophylactic therapy of certain diseases and conditions such as inflammatory diseases (non limiting example(s) include, psoriasis), autoimmune diseases (non limiting example(s) include, rheumatoid arthritis, multiple sclerosis), graft rejection (non limiting example(s) include, allograft rejection, xenograft rejection), infectious diseases (e.g , tuberculoid leprosy), fixed drug eruptions, cutaneous delayed-type hypersensitivity responses, ophthalmic inflammation, type I diabetes, viral meningitis and tumors using a compound of Formula 1.

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