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N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate | CAS No. 773092-05-0

N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate

Basic Information

Chemical_Structure_Of
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CAS Number

773092-05-0

Molecular Formula

C21H37ClN4O8S

Molecular Weight

541.07 g/mol

AD

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids
Basic Chemical Raw Materials Organic Chemicals Ethers
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
Agricultural Chemicals Pesticides Herbicides
Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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CC(C)N(CCNC(=O)C1=CSC(=N1)NC(=O)C2=CC(=C(C=C2O)OC)OC)C(C)C.O.O.O.Cl

InChI

InChI=1S/C21H30N4O5S.ClH.3H2O/c1-12(2)25(13(3)4)8-7-22-20(28)15-11-31-21(23-15)24-19(27)14-9-17(29-5)18(30-6)10-16(14)26;;;;/h9-13,26H,7-8H2,1-6H3,(H,22,28)(H,23,24,27);1H;3*1H2

InChIKey

NPTDXIXCQCFGKC-UHFFFAOYSA-N

LogP

0.9145000000000008

Topological Polar Surface Area

207.52000000000004 Ų

Hydrogen Bond Donor/Acceptor

9 / 12

Complexity

586

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

  • Q27284960
  • Z-338
  • UNII-NMW7447A9A
  • Z-338 HCl
  • Acotiamide (monohydrochloride trihydrate)
  • J-519540
  • ACOTIAMIDE HYDROCHLORIDE TRIHYDRATE [MI]
  • CHEMBL2107308
  • YM443
  • ACOTIAMIDE HYDROCHLORIDE TRIHYDRATE [WHO-DD]
  • CCG-269964
  • BCP09343
  • N-{2-[bis(propan-2-yl)amino]ethyl}-2-(2-hydroxy-4,5-dimethoxybenzamido)-1,3-thiazole-4-carboxamide trihydrate hydrochloride
  • YM-443
  • Acofide trihydrate
  • N-(2-(Bis(1-methylethyl)amino)ethyl)-2-((2-hydroxy-4,5-dimethoxybenzoyl)amino)thiazole-4-carboxamide monohydrochloride trihydrate
  • 4-Thiazolecarboxamide, N-(2-(bis(1-methylethyl)amino)ethyl)-2-((2-hydroxy-4,5-dimethoxybenzoyl)amino)-, monohydrochloride, trihydrate
  • A855302
  • CS-0020306
  • AMY23311
  • D08838
  • Acotiamide hydrochloride [USAN]
  • Acotiamide hydrochloride hydrate (JAN)
  • YM-443 HCl
  • Acotiamide hydrochloride trihydrate
  • DS-8921
  • Acotiamide HCl trihydrate
  • AKOS025404979
  • N-(2-(diisopropylamino)ethyl)-2-(2-hydroxy-4,5-dimethoxybenzamido)thiazole-4-carboxamide hydrochloride trihydrate.
  • SB19648
  • SY115603

MDL Number

MFCD23103502

FAQ

What is N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate (CAS: 773092-05-0)?
N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate (CAS: 773092-05-0) is a white crystalline solid commonly used in pharmaceutical research. It contains a thiazole ring with multiple functional groups, including a hydroxyl, methoxy, and amino substituents, making it a versatile compound for drug development. The hydrochloride salt form enhances its solubility, and the trihydrate indicates the presence of three water molecules per molecule of the compound.

What are the main uses of N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate (CAS: 773092-05-0)?
This compound is primarily used in pharmaceutical research for its potential as a therapeutic agent. It is also employed in the synthesis of various bioactive molecules and may serve as an intermediate in drug development. Due to its chemical structure, it is of interest in studies related to enzyme inhibition and receptor modulation, contributing to the development of new treatments for diseases such as cancer and inflammatory disorders.

Is N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate (CAS: 773092-05-0) safe?
The safety of N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate (CAS: 773092-05-0) depends on its application. It is generally considered safe when handled properly in laboratory settings. However, it is advisable to follow standard chemical safety protocols, including the use of gloves, goggles, and a fume hood. Safety data sheets should be consulted for specific handling and disposal guidelines.

How should N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate (CAS: 773092-05-0) be stored?
N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamine hydrochloride trihydrate (CAS: 773092-05-0) should be stored in a cool, dry, and dark place to maintain its stability. It is recommended to keep it in a sealed container away from moisture and light. Storage at temperatures below 25°C is ideal, and it should be protected from potential contaminants to ensure its quality and effectiveness.

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N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate — ShenZhenZhenJiangShengWuJiShu Co Ltd

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N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate — ShangHaiJiZhiShengHua Technology Co Ltd

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N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate — Shanghai Yuyeh Biotechnology Co., Ltd.

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N-[2-(Diisopropylamino)ethyl]-2-[(2-hydroxy-4,5-dimethoxybenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride trihydrate — HePeng （ ShangHai ） Biotechnology Co Ltd

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