Argatroban Impurity 35

Basic Information

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CAS Number

121785-71-5

Molecular Formula

C23H36N6O5S

Molecular Weight

508.65 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

SMILES

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C[C@@H]1CCN([C@H](C1)C(=O)O)C(=O)[C@H](CCCN=C(N)N)NS(=O)(=O)c2cccc3c2NCC(C3)C

InChI

InChI=1S/C23H36N6O5S/c1-14-8-10-29(18(12-14)22(31)32)21(30)17(6-4-9-26-23(24)25)28-35(33,34)19-7-3-5-16-11-15(2)13-27-20(16)19/h3,5,7,14-15,17-18,27-28H,4,6,8-13H2,1-2H3,(H,31,32)(H4,24,25,26)/t14-,15?,17+,18-/m1/s1

InChIKey

KXNPVXPOPUZYGB-IOVMHBDKSA-N

LogP

0.702900000000005

Topological Polar Surface Area

180.20999999999998 Å²

Hydrogen Bond Donor/Acceptor

7 / 11

Synonyms & References

English

Argatroban
(2R,4R)-1-[(2S)-5-(Diaminomethylideneamino)-2-[[(3R)-3-methyl-1,2,3,4-tetrahydroquinolin-8-yl]sulfonylamino]pentanoyl]-4-methylpiperidine-2-carboxylic acid
(2R,4R)-1-[(2S)-5-(diaminomethylideneamino)-2-[[(3R)-3-methyl-1,2,3,4-tetrahydroquinolin-8-yl]sulfonylamino]pentanoyl]-4-methyl-piperidine-2-carboxylic acid
21R-Argatroban
(21S)-argatroban
(2R,4R)-1-[(2S)-[(aminoiminomethyl)amino]-1-oxo
(2R,4R)-1-[(2S)-[(aminoiminomethyl)amino]-1-oxo-2-[[[(3S)-1,2,3,4-tetrahydro-3-methyl-8-quinolinyl]sulfonyl]amino]pentyl]-4-methyl-2-piperidine carboxylic acid
21 (R) argatroban
21 (S) argatroban
21-(S)-argatroban
21(S)-Argatroban
293849_ALDRICH
5-methyl-1H-[2-14C]pyrimidine-2,4-dione
Phenylacetic acid-2-13C
Phenylessigsaeure (1-13C)
Thymin-2-(14C)
Thymin-2-14C
(2R,4R)-1-[(2S)-5-guanidino-2-[[(3R)-3-methyl-1,2,3,4-tetrahydroquinolin-8-yl]sulfonylamino]pentanoyl]-4-methyl-pipecolinic acid
(2R,4R)-1-[(2S)-5-[bis(azanyl)methylideneamino]-2-[[(3R)-3-methyl-1,2,3,4-tetrahydroquinolin-8-yl]sulfonylamino]pentanoyl]-4-methyl-piperidine-2-carboxylic acid
(2R,4R)-1-[(2S)-5-[(AMinoiMinoMethyl)aMino]-1-oxo-2-[[[(3R)-1,2,3,4-tetrahydro-3-Methyl-8-quinolinyl]sulfonyl]aMino]pentyl]-4-Methyl-2-piperidinecarboxylic Acid
2-Piperidinecarboxylicacid,1-[(2S)-5-[(aminoiminomethyl)amino]-1-oxo-2-[[[(3R)-1,2,3,4-tetrahydro-3-methyl-8-quinolinyl]sulfonyl]amino]pentyl]-4-methyl-,(2R,4R)-

MDL Number

MFCD23102419

FAQ

What regulatory guidelines apply to Argatroban Impurity 35 (CAS: 121785-71-5)?

Argatroban Impurity 35 (CAS: 121785-71-5) must comply with the Bureau of Industry and Security (BIS) Export Administration Regulations (EAR), the REACH regulations for EU, and the FDA/EPA guidelines for pharmaceutical and chemical substances. It is also subject to GHS (Globally Harmonized System) classification for hazardous substances.

Are there alternatives to Argatroban Impurity 35 (CAS: 121785-71-5) in synthesis?

In synthesis, alternative reagents like argatroban or other anticoagulants such as bivalirudin can be used as substitutes for Argatroban Impurity 35 (CAS: 121785-71-5). These alternatives offer similar functionalities and can be chosen based on availability, cost, and specific requirements of the synthesis process.

What is the market or research trend for Argatroban Impurity 35 (CAS: 121785-71-5)?

The market for Argatroban Impurity 35 (CAS: 121785-71-5) is driven by increasing demand in the pharmaceutical and biotechnology sectors. Research trends focus on developing more effective anticoagulants and improving the purity of argatroban. Advances in synthetic chemistry and biopharmaceuticals are likely to influence the future trends in this compound.

How should waste containing Argatroban Impurity 35 (CAS: 121785-71-5) be handled?

Waste containing Argatroban Impurity 35 (CAS: 121785-71-5) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method for disposing of hazardous waste. Ensure all environmental protection precautions are taken to prevent contamination of soil and water sources.