398491-59-3

Basic information

• Product Name: 5N-BOC-3-AMINO-4,6-DIHYDRO-1H-PYRROLO[3,4-C]PYROZOLE
• Synonyms: 5N-BOC-3-AMINO-4,6-DIHYDRO-1H-PYRROLO[3,4-C]PYROZOLE;TERT-BUTYL 3-AMINO-4,6-DIHYDROPYRROLO[3,4-C]PYRAZOLE-5(1H)-CARBOXYLATE;5-BOC-3-AMINO-4,6-DIHYDRO-PYRROLO[3,4-C]PYROZOLE;tert-butyl 3-aminopyrrolo[3,4-c]pyrazole-5(1H,4H,6H)-carboxylate;3-Amino-5-Boc-pyrrolo[3,4-c]pyrazole;tert-Butyl 3-amino-4,6-dihydropyrrolo[3,4-C]pyrozole-5-carboxylate;5-Boc-3-amino-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole;3-Amino-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole-5-carboxylic acid tert-butyl ester
• CAS NO: 398491-59-3
• Molecular Formula: C₁₀H₁₆N₄O₂
• Molecular Weight: 224.26
• Product Categories: CHIRAL CHEMICALS
• Mol File: 398491-59-3.mol
• Article Data: 11

Chemical Properties

• Melting Point: 167-169 °C(Solv: isopropanol (67-63-0))
• Boiling Point: 433.038 °C at 760 mmHg
• Flash Point: 215.694 °C
• Appearance: /
• Density: 1.315 g/cm³
• Vapor Pressure: 3.48E-05mmHg at 25°C
• Refractive Index: 1.64
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• PKA: 16.32±0.20(Predicted)
• CAS DataBase Reference: 5N-BOC-3-AMINO-4,6-DIHYDRO-1H-PYRROLO[3,4-C]PYROZOLE(CAS DataBase Reference)
• NIST Chemistry Reference: 5N-BOC-3-AMINO-4,6-DIHYDRO-1H-PYRROLO[3,4-C]PYROZOLE(398491-59-3)
• EPA Substance Registry System: 5N-BOC-3-AMINO-4,6-DIHYDRO-1H-PYRROLO[3,4-C]PYROZOLE(398491-59-3)

Safety Data

• Hazardous Substances Data: 398491-59-3(Hazardous Substances Data)

Usage

General Description

5N-BOC-3-AMINO-4,6-DIHYDRO-1H-PYRROLO[3,4-C]PYROZOLE is a chemical compound with the molecular formula C16H20N4O2. It is a pyrrolopyrazole derivative and is often used in the synthesis of pharmaceuticals and agrochemicals. 5N-BOC-3-AMINO-4,6-DIHYDRO-1H-PYRROLO[3,4-C]PYROZOLE is notable for its BOC (tert-butyloxycarbonyl) protected amine group, which makes it useful in organic synthesis for protecting other functional groups while reactions are carried out. The compound is also known for its potential interactions with biological targets, making it a subject of interest in medicinal and pharmaceutical research. Overall, 5N-BOC-3-AMINO-4,6-DIHYDRO-1H-PYRROLO[3,4-C]PYROZOLE is a versatile chemical with potential applications in various fields.

InChI:InChI=1/C10H18N4O2/c1-10(2,3)16-9(15)14-4-6-7(5-14)12-13-8(6)11/h6-7,12H,4-5H2,1-3H3,(H2,11,13)

Upstream product

• 175463-32-8 3-cyano-4-oxopyrrolidine-1-carboxylic acid tert-butyl ester 
• 266353-19-9 [tert-butoxycarbonyl-(2-cyanoethyl)amino]acetic acid methyl ester 
• 3088-42-4 N-(2-cyanoethyl)glycine 
• 24424-99-5 di-tert-butyl dicarbonate 
• 44981-94-4 N-cyanoethyl glycine ethyl ester 
• 266353-18-8 N-tert-butoxycarbonyl-2-(2-cyanoethyl)aminoacetic acid ethyl ester 
• 14011-37-1 hydrazine dihydrochloride 
• 44915-39-1 [(2-cyanoethyl)amino]acetic acid methyl ester 

Downstream Products

• 945217-57-2 tert-butyl 3-{[(benzyloxy)carbonyl]amino}-4,6-dihydropyrrolo[3,4-c]pyrazole-5(1H)-carboxylate 
• 827318-96-7 5-[(2R)-2-hydroxy-2-phenylethanoyl]-3-{[4-(4-methylpiperazin-1-yl)benzoyl]amino}-5,6-dihydropyrrolo[3,4-c]pyrazole-1(4H)-carboxylate 
• 916995-47-6 3-[4-(4-methyl-piperazin-1-yl)-benzoylamino]-5-(2-phenyl-propionyl)-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole-1-carboxylic acid ethyl ester 
• 916995-46-5 3-[4-(4-methyl-piperazin-1-yl)-benzoylamino]-5-(2-phenyl-propionyl)-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole-1-carboxylic acid ethyl ester 
• 916995-45-4 5-(fluoro-phenyl-acetyl)-3-[4-(4-methyl-piperazin-1-yl)-benzoylamino]-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole-1-carboxylic acid ethyl ester 
• 916995-48-7 5-(methoxy-phenyl-acetyl)-3-[4-(4-methyl-piperazin-1-yl)-benzoylamino]-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole-1-carboxylic acid ethyl ester 
• 827318-78-5 5-((R)-2-methoxy-2-phenylacetyl)-3-[4-(4-methylpiperazin-1-yl)benzoylamino]-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole-1-carboxylic acid ethyl ester 
• 916995-51-2 PHA₇₃₉₃₅₈ 
• 916995-51-2 danusertib 
• 761443-50-9 3-[4-(N-methylpiperazin-1-yl)benzamido]-1-ethoxycarbonyl-4,6-dihydropyrrolo[3,4-c]pyrazole 
• 761443-69-0 5-tert-butyl 1-ethyl 3-{[4-(4-methylpiperazin-1-yl)benzoyl]amino}-4,6-dihydropyrrolo[3,4-c]pyrazole-1,5-dicarboxylate 
• 398495-65-3 3-amino-4,6-dihydro-pyrrolo[3,4-c]pyrazole-1,5-dicarboxylic acid 5-tert-butyl ester 1-ethyl ester 
• 1417536-31-2 N-(1-acetyl-5-isonicotinoyl-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-3-yl)benzamide 
• 1151656-05-1 tert-butyl 3-(4-fluorobenzamido)pyrrolo[3,4-c]pyrazole-5(1H,4H,6H)-carboxylate 

Relevant articles and documents

Dipeptidyl peptidase-IV inhibitor-aminotetrahydropyrane derivative

The invention provides a DPPIV inhibitor which has the structure shown as the formula (I) (please see the formula (I) in the description). Experiments show that the inhibitor can effectively inhibit the activity of dipeptidyl peptidase IV (DPPIV) and be used for preventing DPPIV-mediated diseases or delaying progress of the DPPIV-mediated diseases or treating the DPPIV-mediated diseases, particularly 2 type and 1 type diabetes, obesity, arthritis, osteoporosis and part of tumors. The invention further provides a preparation method of the inhibitor.

The discovery of novel 5,6,5- and 5,5,6-tricyclic pyrrolidines as potent and selective DPP-4 inhibitors

Novel potent and selective 5,6,5- and 5,5,6-tricyclic pyrrolidine dipeptidyl peptidase IV (DPP-4) inhibitors were identified. Structure-activity relationship (SAR) efforts focused on improving the intrinsic DPP-4 inhibition potency, increasing protease se

Structure-activity-relationship of amide and sulfonamide analogs of omarigliptin

A series of novel substituted-[(3R)-amino-2-(2,5-difluorophenyl)]tetrahydro-2H-pyran analogs have been prepared and evaluated as potent, selective and orally active DPP-4 inhibitors. These efforts lead to the discovery of a long acting DPP-4 inhibitor, omarigliptin (MK-3102), which recently completed phase III clinical development and has been approved in Japan.