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4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester is a chemical compound with the molecular formula C16H24N2O2. It is an ester derivative of 4-(4-pyridinyl)-1-piperidinecarboxylic acid, characterized by its white powder form and a molecular weight of 276.372 g/mol. 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester is recognized for its potential in medicinal chemistry and drug discovery, attributed to its structural features and reactivity.

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  • 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester

    Cas No: 550371-76-1

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  • 550371-76-1 Structure
  • Basic information

    1. Product Name: 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester
    2. Synonyms: 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester;4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester;tert-Butyl 4-(4-pyridinyl)-1-piperidinecarboxylate;4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1
    3. CAS NO:550371-76-1
    4. Molecular Formula: C15H22N2O2
    5. Molecular Weight: 262.351
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 550371-76-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 371℃
    3. Flash Point: 178℃
    4. Appearance: /
    5. Density: 1.083
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester(CAS DataBase Reference)
    10. NIST Chemistry Reference: 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester(550371-76-1)
    11. EPA Substance Registry System: 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester(550371-76-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 550371-76-1(Hazardous Substances Data)

550371-76-1 Usage

Uses

Used in Organic Synthesis:
4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester is used as a reagent in organic synthesis for its ability to contribute to the formation of various bioactive molecules. Its ester functionality and pyridine ring make it a versatile building block in the creation of complex organic compounds.
Used in Pharmaceutical Research:
In the pharmaceutical industry, 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester is utilized as a key intermediate in the development of new drugs. Its structural attributes allow it to be incorporated into potential therapeutic agents, particularly those targeting the central nervous system or other biological pathways where pyridine-containing molecules are known to be active.
It is important to handle and store 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester according to proper laboratory safety protocols to ensure the safety of researchers and the integrity of experiments.

Check Digit Verification of cas no

The CAS Registry Mumber 550371-76-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 5,5,0,3,7 and 1 respectively; the second part has 2 digits, 7 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 550371-76:
(8*5)+(7*5)+(6*0)+(5*3)+(4*7)+(3*1)+(2*7)+(1*6)=141
141 % 10 = 1
So 550371-76-1 is a valid CAS Registry Number.

550371-76-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name tert-butyl 4-pyridin-4-ylpiperidine-1-carboxylate

1.2 Other means of identification

Product number -
Other names 4-(4-Pyridinyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl 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:550371-76-1 SDS

550371-76-1Downstream Products

550371-76-1Relevant articles and documents

Photoredox-catalysed regioselective synthesis of C-4-alkylated pyridines with N -(acyloxy)phthalimides

He, Qian,Yang, Chunhao,Zhang, Xiaofei,Zhang, Zhucheng

, p. 1969 - 1973 (2022/03/15)

A method of direct C-4 selective alkylation of pyridines under visible light irradiation at room temperature has been reported, using simple maleate-derived pyridinium salts as pyridine precursors and the readily available carboxylic acid-derived N-(acyloxy)phthalimides as alkyl radical precursors, affording good to excellent yields without using stoichiometric oxidants and acids. A broad range of primary, secondary, and tertiary carboxylates can be used as alkylation reagents. Oxidant and acid-sensitive functional groups can be tolerated well. This journal is

INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX KINASE ("NACK") AND METHODS FOR USE OF THE SAME

-

Paragraph 00151, (2019/08/29)

Disclosed herein are Notch transcriptional activation complex kinase ("NACK") inhibitors, and methods for their use in treating or preventing diseases, such as cancer. The inhibitors described herein include compounds of Formula (la) and pharmaceutically acceptable salts thereof: wherein the substituents are as described.

Design, synthesis, and pharmacological evaluation of JDTic analogs to examine the significance of replacement of the 3-hydroxyphenyl group with pyridine or thiophene bioisosteres

Kormos, Chad M.,Gichinga, Moses G.,Runyon, Scott P.,Thomas, James B.,Mascarella, S. Wayne,Decker, Ann M.,Navarro, Hernán A.,Carroll, F. Ivy

, p. 3842 - 3848 (2016/07/21)

The potent and selective KOR antagonist JDTic was derived from the N-substituted trans-3,4-dimethyl-4-(3-hydroxyphenyl)piperidine class of pure opioid antagonists. In previous studies we reported that compounds that did not have a hydroxyl on the 3-hydroxyphenyl group and did not have methyl groups at the 3- and 4-position of the piperidine ring were still potent and selective KOR antagonists. In this study we report JDTic analogs 2, 3a–b, 4a–b, and 5, where the 3-hydroxyphenyl ring has been replaced by a 2-, 3-, or 4-pyridyl or 3-thienyl group and do not have the 3-methyl or 3,4-dimethyl groups, remain potent and selective KOR antagonists. Of these, (3R)-7-hydroxy-N-(1S)-2-methyl-[4-methyl-4-pyridine-3-yl-carboxamide (3b) had the best overall binding potency and selectivity in a [35S]GTPγS functional assay, with a Ke?=?0.18?nM at the KOR and 273- and 16,700-fold selectivity for the KOR relative to the MOR and DOR, respectively. Calculated physiochemical properties for 3b suggest that it will cross the blood–brain barrier.

DIARYL KETIMINE DERIVATIVE HAVING ANTAGONISM AGAINST MELANIN-CONCENTRATING HORMONE RECEPTOR

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Page/Page column 34, (2010/12/31)

[Problems] To provide an antagonist of a melanin-concentrating hormone receptor, which is useful as a medicine for a central nervous system disease, a cardiovascular disease or a metabolic disease. [Means for Solving Problems] The antagonist comprises, as an active ingredient, a compound represented by the formula (I) wherein R1a and R1b independently represent a hydrogen atom or a C1-6 alkyl group; R2a, R2b, R3a and R3b independently represent a hydrogen atom, a C1-6 alkyl group, or the like; Y represents H or —OH; Z represents —OR8, or the like; R8 represents a hydrogen atom, a C1-6 alkyl group which may have a substituent, or the like; R9a and R9b independently represent a hydrogen atom, a C1-6 alkyl group, or the like; Ar1 represents an aromatic carbon ring group, or an aromatic heteroring group; Ar2 represents a group produced by removing two hydrogen atoms from an aromatic carbon ring, or the like; and the ring group A represents an unsaturated heteroring group.

DERIVATIVES OF UREAS OF PIPERIDINE OR PYRROLIDINE, THEIR PREPARATION AND THEIR THERAPEUTICAL USE

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Page/Page column 27, (2009/07/18)

The present invention is related to a compound of formula (I): wherein i, j, n, o, p, q, r, R1a, R1b, R1c, R1d, R2a, R2b, R2c, R2d, R3a, R3b and R4 are as defined herein, or an addition salt with an acid thereof, or a hydrate or solvate thereof, its preparation, pharmaceutical composition, and uses for treating a disease in which the enzyme 11β-HSD1 is involved.

Wrenchnolol derivative optimized for gene activation in cells

Jung, Dongju,Shimogawa, Hiroki,Kwon, Youngjoo,Mao, Qian,Sato, Shin-ichi,et al.

supporting information; experimental part, p. 4774 - 4782 (2009/09/26)

Naturally occurring transcription factors usually have two independent domains, a DNA-binding domain and an activation domain. In designing a synthetic small molecule that mimics a transcription factor, each of the two domains needs to be replaced by small-molecule counterparts. Results of the present study show that derivatives of wrenchnolol, a synthetic molecule that interacts with Sur-2 coactivator, serve as activation modules and stimulate gene transcription in vitro and in cells when tethered to a DNA-binding molecule. Thirteen derivatives of wrenchnolol were chemically synthesized and tested for their ability to activate transcription in vitro and in cells. When tethered to the GAL4 DNA-binding domain, one derivative increased transcription of a GAL4-responsive reporter genein cells 9-fold. This optimized derivative also induced up to 45percent myogenesis of C2C12 cells when tethered to the DNA-binding domain of my ogenic transcription factor MyoD. This optimized derivative may serve asa starting point for designing biological tools or components of fully synthetic transcription factors that permit selective up-regulation of g enes.

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