Manitimus - Moligand™, ≥99% , CAS No.202057-76-9

CAS: 202057-76-9 Cat. No.: M646602 分子式: C15H11F3N2O2 分子量: 308.26 PubChem CID: 54686843
注文可能
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
Synonyms
2-Cyano-3-hydroxy-N-(4-(trifluoromethyl)phenyl)-2-hepten-6-ynoic acid | BM162377 | (Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]hept-2-en-6-ynamide | 4B135RK2KL | MNA-715 | DB06481 | UNII-4B135RK2KL | FK 778 | (2Z)-2-CYANO-3-HYDROXY-N-(4-(TRIFLUOROM
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
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Size
USA
ドイツ (EU)*
Price
Qty
1mg
M646602-1mg
受注生産 · 8~12週間
$187.90
5mg
M646602-5mg
受注生産 · 8~12週間
$659.90
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™, ≥99% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -20°C Ships Ice chest + Ice pads 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

Manitimus is an inhibitor of dehydroorotate dehydrogenase, and a potent immunosuppressive agent.

In Vivo

In the Manitimus-treated rats, there is a dose-related, differential effect: mean survival is 15.7 days in group 4 (Manitimus 5 mg/kg), 19.1 days in group 5 (Manitimus 10 mg/kg) and 25.4 days in group 6 (Manitimus 20 mg/kg) . Manitimus (15 mg/kg, p.o.) results in a significant decrease in neointimal area and percentage of stenosis versus the control rats, and diminishes the effect that CMV infection results in a significant increase in intimal and medial cross-sectional area and medial wall thickness of the vein grafts. MCE has not independently confirmed the accuracy of these methods. They are for reference only. 

Animal administration

The whole experiment consists of a total of four experimental groups (n = 10 animals/group) which all undergo surgery. Furthermore, rats are either infected with CMV, treated with Manitimus\nor both. A control group only receive the Manitimus solvent (1 mL of a 1% carboxymethylcellulose solution in water). Infection is established by inoculating rats intraperitoneally with 1.25×10 6 plaque-forming units of homogenized salivary gland-derived rat CMV immediately after surgery. aladdin has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

Specifications

同義語
2-Cyano-3-hydroxy-N-(4-(trifluoromethyl)phenyl)-2-hepten-6-ynoic acid | BM162377 | (Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]hept-2-en-6-ynamide | 4B135RK2KL | MNA-715 | DB06481 | UNII-4B135RK2KL | FK 778 | (2Z)-2-CYANO-3-HYDROXY-N-(4-(TRIFLUOROM
仕様と純度
Moligand™, ≥99%
生化学的・生理学的メカニズム
Manitimus is an inhibitor of dehydroorotate dehydrogenase, and a potent immunosuppressive agent.
保管条件
Store at -20°C
入荷
Ice chest + Ice pads
この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。
等級
Moligand™
純度
≥99%
名前と識別子
カノニカル・スマイルC#CCCC(=C(C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F)O
IUPAC Name(Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]hept-2-en-6-ynamide
InChIKeyIRELROQHIPLASX-SEYXRHQNSA-N
INCHI1S/C15H11F3N2O2/c1-2-3-4-13(21)12(9-19)14(22)20-11-7-5-10(6-8-11)15(16,17)18/h1,5-8,21H,3-4H2,(H,20,22)/b13-12-
異性体SMILES C#CCC/C(=C(\C#N)/C(=O)NC1=CC=C(C=C1)C(F)(F)F)/O
代替CAS番号 202057-76-9,185915-33-7
PubChem CID 54686843
MeSH用語 2-cyano-3-hydroxy-N-(4-(trifluoromethyl)phenyl)-2-hepten-6-ynamide;2-cyano-3-hydroxy-N-(4--(trifluoromethyl)phenyl)-2-hepten-6-ynoic acid;FK 778;FK-778;FK778;HMR 1715;HMR-1715;malononitrilamide 715;malononitrilamide-715;MNA 715;MNA-715;MNA-X 920715;X 9207
分子量 308.26

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

KingdomOrganic compounds
SuperclassBenzenoids
分類Benzene and substituted derivatives
SubclassTrifluoromethylbenzenes
Intermediate Tree Nodes Not available
Direct ParentTrifluoromethylbenzenes
Alternative Parents Anilides  N-arylamides  Vinylogous acids  Secondary carboxylic acid amides  Nitriles  Enols  Acetylides  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl fluorides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Trifluoromethylbenzene - Anilide - N-arylamide - Vinylogous acid - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Enol - Acetylide - Carbonitrile - Nitrile - Alkyl fluoride - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Aromatic homomonocyclic compound
説明This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors Not available
3 D構造
インタラクティブ化学構造モデル





作用メカニズム
証明書(CoA、COO、BSE/TSEと分析図)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
化学的性質と物理的性質
溶解度DMSO : 250 mg/mL (811.00 mM; Need ultrasonic)
分子量308.250 g/mol
XLogP33.700
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass308.077 Da
Monoisotopic Mass308.077 Da
Topological Polar Surface Area73.100 Ų
Heavy Atom Count22
Formal Charge0
Complexity540.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds1
Covalently-Bonded Unit Count1
ソリューション計算機
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