186650-98-6

Basic information

• Product Name: TERT-BUTYL 4-(4-CYANOPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
• Synonyms: BUTTPARK 98\06-100;4-(PIPERAZIN-4-YL)BENZONITRILE, N1-BOC PROTECTED;TERT-BUTYL 4-(4-CYANOPHENYL)PIPERAZINE-1-CARBOXYLATE;TERT-BUTYL 4-(4-CYANOPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE;4-(Piperazin-4-yl)benzonitrile, N1-BOC protected 97%;1-Boc-4-(4-cyanophenyl)piperazine;4-(4-Cyano-phenyl)-piperazine-1-carboxylic acid tert-butyl ester;4-(Piperazin-4-yl)benzonitrile,N1-BOCprotected97%
• CAS NO: 186650-98-6
• Molecular Formula: C₁₆H₂₁N₃O₂
• Molecular Weight: 287.36
• Mol File: 186650-98-6.mol
• Article Data: 15

Chemical Properties

• Melting Point: 128-126°C
• Boiling Point: 445.7 °C at 760 mmHg
• Flash Point: 223.4 °C
• Appearance: /
• Density: 1.17 g/cm³
• Vapor Pressure: 3.86E-08mmHg at 25°C
• Refractive Index: 1.571
• CAS DataBase Reference: TERT-BUTYL 4-(4-CYANOPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE(CAS DataBase Reference)
• NIST Chemistry Reference: TERT-BUTYL 4-(4-CYANOPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE(186650-98-6)
• EPA Substance Registry System: TERT-BUTYL 4-(4-CYANOPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE(186650-98-6)

Safety Data

• Hazard Codes: Harmful:
• HazardClass: IRRITANT
• Hazardous Substances Data: 186650-98-6(Hazardous Substances Data)

Usage

General Description

TERT-BUTYL 4-(4-CYANOPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE is a chemical compound with the molecular formula C19H24N2O2. It is a tetrahydropyrazinecarboxylate derivative with a tert-butyl group and a 4-cyanophenyl substituent. TERT-BUTYL 4-(4-CYANOPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE is commonly used in the pharmaceutical industry as a building block for the synthesis of various bioactive molecules. It may also have potential applications in the field of medicinal chemistry and drug discovery. TERT-BUTYL 4-(4-CYANOPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE is classified as a hazardous chemical and should be handled and stored with proper safety precautions.

InChI:InChI=1/C16H21N3O2/c1-16(2,3)21-15(20)19-10-8-18(9-11-19)14-6-4-13(12-17)5-7-14/h4-7H,8-11H2,1-3H3

Upstream product

• 623-00-7 4-bromobenzenecarbonitrile 
• 57260-71-6 1-t-Butoxycarbonylpiperazine 
• 1118-03-2 trimethyltin azide 
• 24424-99-5 di-tert-butyl dicarbonate 
• 68104-63-2 N-(4-cyanophenyl)piperazine 
• 623-03-0 4-Cyanochlorobenzene 
• 34916-10-4 4-cyanocyclohexanone 
• 1194-02-1 4-fluorobenzonitrile 

Downstream Products

• 197638-83-8 4-(4-(1,1-dimethylethoxycarbonyl)piperazinyl)benzaldehyde 
• 852180-47-3 tert-butyl 4-[4-(aminomethyl)phenyl]piperazine-1-carboxylate 
• 831203-80-6 5-nitro-furan-2-carboxylic acid 4-piperazin-1-yl-benzylamide 
• 831203-79-3 4-(4-{[(5-nitro-furan-2-carbonyl)-amino]-methyl}-phenyl)-piperzine-1-carboxylic acid ter-butyl ester 
• 179328-87-1 4-(4-{[Ethyl-(2-ethylamino-ethyl)-amino]-methyl}-phenyl)-piperazine-1-carboxylic acid tert-butyl ester 
• 179328-27-9 4-(4-{[Ethyl-(2-{ethyl-[4-oxo-4-(6-oxo-5,6-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-11-yl)-butyryl]-amino}-ethyl)-amino]-methyl}-phenyl)-piperazine-1-carboxylic acid tert-butyl ester 
• 1291057-86-7 4-[4-(3-benzo[b]thiophen-3-yl-3-hydroxypropyl)piperazin-1-yl]benzonitrile 
• 1291057-72-1 4-[4-(3-benzo[b]thiophen-3-yl-3-oxopropyl)piperazin-1-yl]benzonitrile 
• 68104-63-2 N-(4-cyanophenyl)piperazine 
• 1403940-97-5 6-chloro-2-ethyl-N-(4-(4-(4-fluorobenzoyl)piperazin-1-yl)benzyl)imidazo[1,2-a]pyridine-3-carboxamide 

Relevant articles and documents

Electrochemical Cross-Dehydrogenative Aromatization Protocol for the Synthesis of Aromatic Amines

The introduction of amines onto aromatics without metal catalysts and chemical oxidants is synthetically challenging. Herein, we report the first example of an electrochemical cross-dehydrogenative aromatization (ECDA) reaction of saturated cyclohexanones and amines to construct anilines without additional metal catalysts and chemical oxidants. This reaction exhibits a broad scope of cyclohexanones including heterocyclic ketones, affording a variety of aromatic amines with various functionalities, and shows great potential in the synthesis of biologically active compounds.

Synthesis and antitubercular evaluation of reduced lipophilic imidazo[1,2-a]pyridine-3-carboxamide derivatives

A series of reduced lipophilic N-benzylic imidazo[1,2-a]pyridine carboxamides (IPAs) with various side chains were designed and synthesized as new anti-TB agents in this work. Five derivatives A2, A3, A4, B1 and B9 exhibit excellent in vitro activity (MIC: 0-∞ and Cmax than Q203 and PBTZ169, suggesting its promising potential to be a lead compound for future antitubercular drug discovery.

METALLOENZYME INHIBITOR COMPOUNDS

The instant invention describes compounds having metalloenzyme modulating activity, and methods of treating diseases, disorders or symptoms thereof mediated by such metalloenzymes.