74874-10-5

Basic information

• Product Name: 2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S*), 2ALPHA, 4BETA]]-
• Synonyms: 2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S*), 2ALPHA, 4BETA]]-;2-PIPERIDINECARBOXYLIC ACID, 1-[5-[[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SUFONYL]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S*), 2ALPHA, 4BETA]]-;(2R,4R)-1-[Nitroglycerine-nitro-N2-(3-methyl-8-quinolinesulfonyl)-L-arginyl]-4-methyl-2-piperidinecarboxylic acid;[2R-[1(S*),2α,4β]]-1-[5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-;(2R,4R)-1-[(2S)-5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-Piperidinecarboxylic acid;[2R-[1(S*),2α,4β]]-1-[5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarboxylic acid;N-Nitro-1,2,3,4-tetradehydro Argatroban;Argatroban-6
• CAS NO: 74874-10-5
• Molecular Formula: C₂₃H₃₁N₇O₇S
• Molecular Weight: 549.6
• Product Categories: Aromatics;Chiral Reagents;Heterocycles;Intermediates & Fine Chemicals;Pharmaceuticals;Sulfur & Selenium Compounds
• Mol File: 74874-10-5.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 814.8 °C at 760 mmHg
• Flash Point: 446.6 °C
• Appearance: /
• Density: 1.53
• Vapor Pressure: 4.54E-28mmHg at 25°C
• Refractive Index: 1.686
• Storage Temp.: Sealed in dry,Store in freezer, under -20°C
• Solubility: DMSO (Slightly), Methanol (Slightly, Heated)
• PKA: 3.34±0.40(Predicted)
• CAS DataBase Reference: 2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S*), 2ALPHA, 4BETA]]-(CAS DataBase Reference)
• NIST Chemistry Reference: 2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S*), 2ALPHA, 4BETA]]-(74874-10-5)
• EPA Substance Registry System: 2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S*), 2ALPHA, 4BETA]]-(74874-10-5)

Safety Data

• Hazardous Substances Data: 74874-10-5(Hazardous Substances Data)

Usage

Description

2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S), 2ALPHA, 4BETA]]is a complex organic compound with a unique chemical structure. It is characterized by its white solid appearance and is an intermediate in the preparation of Argatroban (A769000).

Uses

Used in Pharmaceutical Industry:
2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S), 2ALPHA, 4BETA]]is used as an intermediate in the synthesis of Argatroban (A769000) for its pharmaceutical applications. Argatroban is a small molecule direct thrombin inhibitor that is used to treat patients with heparin-induced thrombocytopenia (HIT). It works by selectively inhibiting thrombin, reducing the risk of clot formation and associated complications in patients with HIT.
Used in Chemical Research:
2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,[2R-[1(S), 2ALPHA, 4BETA]]can also be utilized in chemical research for understanding its properties, reactivity, and potential applications in various fields. Its unique structure may offer insights into the development of new drugs or materials with similar properties.

InChI:InChI=1/C23H31N7O7S/c1-14-8-10-29(18(12-14)22(32)33)21(31)17(6-4-9-25-23(24)27-30(34)35)28-38(36,37)19-7-3-5-16-11-15(2)13-26-20(16)19/h3,5,7,11,13-14,17-18,28H,4,6,8-10,12H2,1-2H3,(H,32,33)(H3,24,25,27)

Downstream Products

• 74863-84-6 argatroban