Name: runcaciguat - Moligand™, ≥98% , Soluble guanylate cyclase activator, CAS No.1402936-61-1, Soluble guanylate cyclase activator
SKU: R613333
Availability: InStock

runcaciguat - Moligand™, ≥98% , Soluble guanylate cyclase activator, CAS No.1402936-61-1, Soluble guanylate cyclase activator

CAS: 1402936-61-1 Cat. No.: R613333 分子式: C₂₃H₂₂Cl₂F₃NO₃ 分子量: 488.33 EC番号: 815-430-1

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runcaciguat - Moligand™, ≥98% CAS No(1402936-61-1) R613333 by Aladdin Scientific

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注文可能

GRADE & PURITY Moligand™ ? ≥98%

Synonyms

Storage

Protected from light,Room temperature

Shipped In

Normal

概要 Specifications 製品の性質名前と識別子 Documentation Advanced Data Taxonomic Classification 3 D構造関連ターゲット（人間）関連ターゲット（非人間）作用メカニズム証明書（CoA、COO、BSE/TSEと分析図）化学的性質と物理的性質ソリューション計算機レビュー

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Why this grade

Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Protected from light,Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

概要

Runcaciguat is an orally active stimulator of soluble guanylate cyclase, and is used in the research of cardiovascular and renal diseases combined with selective partial adenosine A1 receptor agonists.

Specifications

同義語

仕様と純度

Moligand™, ≥98%

保管条件

Protected from light,Room temperature

入荷

Normal

等級

Moligand™

アクションタイプ

ACTIVATOR

作用メカニズム

Soluble guanylate cyclase activator

純度

≥98%

製品の性質

ALogP	6.6

名前と識別子

パブケム・シド	528768739
カノニカル・スマイル	CC(C(C1=CC=C(C=C1)Cl)C(=O)NC2=C(C=CC(=C2)C(CC(=O)O)C3CC3)Cl)C(F)(F)F
IUPAC Name	(3S)-3-[4-chloro-3-[[(2S,3R)-2-(4-chlorophenyl)-4,4,4-trifluoro-3-methylbutanoyl]amino]phenyl]-3-cyclopropylpropanoic acid
InChIKey	NCRMKIWHFXSBGZ-CNBXIYLPSA-N
INCHI	1S/C23H22Cl2F3NO3/c1-12(23(26,27)28)21(14-4-7-16(24)8-5-14)22(32)29-19-10-15(6-9-18(19)25)17(11-20(30)31)13-2-3-13/h4-10,12-13,17,21H,2-3,11H2,1H3,(H,29,32)(H,30,31)/t12-,17+,21+/m1/s1
異性体SMILES	C[C@H]([C@@H](C1=CC=C(C=C1)Cl)C(=O)NC2=C(C=CC(=C2)[C@@H](CC(=O)O)C3CC3)Cl)C(F)(F)F
代替CAS番号	1402936-61-1
MeSH用語	BAY 1101042;runcaciguat
分子量	488.33

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Phenylpropanoids and polyketides
  - 分類 Phenylpropanoic acids

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
分類	Phenylpropanoic acids
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpropanoic acids
Alternative Parents	Phenylacetamides Phenylpropanes Carbocyclic fatty acids Anilides N-arylamides Chlorobenzenes Fatty amides Aryl chlorides Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	3-phenylpropanoic-acid - Phenylacetamide - Anilide - Phenylpropane - Carbocyclic fatty acid - N-arylamide - Halobenzene - Chlorobenzene - Fatty acyl - Benzenoid - Fatty amide - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Secondary carboxylic acid amide - Carboxamide group - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
説明	This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3 D構造

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レビュー

Need help choosing the grade?

Our grade selection guide covers purity, stabilizer status, and application suitability for all variants in our catalog.

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Bulk & Custom Packaging Need larger quantities or custom specifications? Contact our team for a tailored quote.

Lot Number	Certificate Type	日付	商品
H2518665	Certificate of Analysis	Apr 28, 2025	R613333
H2518666	Certificate of Analysis	Apr 28, 2025	R613333
H2518671	Certificate of Analysis	Apr 28, 2025	R613333

感度	light sensitive
分子量	488.300 g/mol
XLogP3	6.600
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	8
Exact Mass	487.093 Da
Monoisotopic Mass	487.093 Da
Topological Polar Surface Area	66.400 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	665.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1