Argatroban Impurity 16

Basic Information

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CAS Number

74874-09-2

Molecular Formula

C25H35N7O7S

Molecular Weight

577.7 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

793.393°C at 760 mmHg

Density

1.44

Flash Point

433.629°C

Refractive Index

1.653

SMILES

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CCOC(=O)C1CC(CCN1C(=O)C(CCCN=C(N)N[N+](=O)[O-])NS(=O)(=O)C2=CC=CC3=C2N=CC(=C3)C)C

InChI

InChI=1S/C25H35N7O7S/c1-4-39-24(34)20-14-16(2)10-12-31(20)23(33)19(8-6-11-27-25(26)29-32(35)36)30-40(37,38)21-9-5-7-18-13-17(3)15-28-22(18)21/h5,7,9,13,15-16,19-20,30H,4,6,8,10-12,14H2,1-3H3,(H3,26,27,29)/t16-,19+,20-/m1/s1

InChIKey

DWOYDKNIEZWRDH-LSTHTHJFSA-N

LogP

4.28050

Complexity

1030

Synonyms & References

English

CS-0151917
(2R,4R)-Ethyl 4-methyl-1-((S)-2-(3-methylquinoline-8-sulfonamido)-5-(3-nitroguanidino)pentanoyl)piperidine-2-carboxylate
ethyl (2R,4R)-4-methyl-1-(N2-((3-methylquinolin-8-yl)sulfonyl)-Nw-nitro-L-arginyl)piperidine-2-carboxylate
2-PIPERIDINECARBOXYLIC ACID, 1-[5-[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-,ETHYL ESTER,[2R-[1(S*), 2ALPHA, 4BETA]]-
ethyl (2R,4R)-1-[(2S)-5-[[amino(nitramido)methylidene]amino]-2-[(3-methylquinolin-8-yl)sulfonylamino]pentanoyl]-4-methylpiperidine-2-carboxylate
Argatroban-5
N-Nitro-1,2,3,4-tetradehydro Argatroban Ethyl Ester
(2R,4R)-1-[(2S)-5-[[IMINO(NITROAMINO)METHYL]AMINO]-2-[[(3-METHYL-8-QUINOLINYL)SULFONYL]AMINO]-1-OXOPENTYL]-4-METHYL-2-PIPERIDINECARBOXYLIC ACID ETHYL ESTER
74874-09-2
DS-5761
(2R,4R)-1-[(2S)-5-[[Imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarb oxylic acid ethyl ester
A865786
DTXSID10453265
2-Piperidinecarboxylic acid, 1-[5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-, ethyl ester, [2R-[1(S*),2alpha,4beta]]-
AKOS016010207
(2r,4r)-1-((2s)-5-((imino(nitroamino)methyl)amino)-2-(((3-methyl-8-quinolinyl)sulfonyl)amino)-1-oxopentyl)-4-methyl-2-piperidinecarboxylic acid ethyl ester
AMY21984
C76394
2-Piperidinecarboxylic acid, 1-[(2S)-5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-, ethyl ester, (2R,4R)-
J-500993
XB7SBV253N
Ethyl (2R,4R)-1-[(2S)-5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarboxylate
(2R,4R)-1-[(2S)-5-[[Imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarboxylic acid ethyl ester
2-Piperidinecarboxylic acid, 1-[5-[[imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-, ethyl ester, [2R-[1(S*),2a,4b]]-
ARGATROBAN INTER-5
N-Nitro-1,2,3,4-tetr
A,4
A]]-1-[5-[[Imino(nitroamino)methyl]amino]-2-[[(3-methyl-8-quinolinyl)sulfonyl]amino]-1-oxopentyl]-4-methyl-2-piperidinecarboxylic Acid Ethyl Ester
C25H35N7O7S
RL04845
Z3355

MDL Number

MFCD08458425

FAQ

What regulatory guidelines apply to Argatroban Impurity 16 (CAS: 74874-09-2)?

Argatroban Impurity 16 (CAS: 74874-09-2) adheres to GHS classification for handling and storage, REACH regulations for European market compliance, and FDA/EPA guidelines for safety assessments and waste management. Ensure all industrial and commercial applications comply with local and international chemical regulations.

Are there alternatives to Argatroban Impurity 16 (CAS: 74874-09-2) in synthesis?

Alternatives to Argatroban Impurity 16 (CAS: 74874-09-2) in synthesis include other anticoagulant agents such as bivalirudin and argatroban itself. Researchers often explore these alternatives based on specific reaction conditions and desired product purity.

What is the market or research trend for Argatroban Impurity 16 (CAS: 74874-09-2)?

Market trends indicate increasing research interest in Argatroban Impurity 16 (CAS: 74874-09-2) for its role in anticoagulant studies. There is a growing focus on its use in drug development and clinical trials, alongside a trend towards more sustainable and environmentally friendly synthetic methods.

How should waste containing Argatroban Impurity 16 (CAS: 74874-09-2) be handled?

Waste containing Argatroban Impurity 16 (CAS: 74874-09-2) should be collected in appropriate containers and disposed of through incineration or professional waste disposal services. Follow local environmental protection regulations to ensure proper disposal and minimize environmental impact.