Mesendogen - Moligand™, ≥98% , CAS No.864716-85-8

CAS: 864716-85-8 Cat. No.: M648787 분자식: C₁₈H₁₆ClF₃N₂OS 분자량: 400.85 PubChem CID: 2173015

GRADE & PURITY Moligand™, ≥98%

Synonyms

N-((2-Chloro-5-(trifluoromethyl)phenyl)carbamothioyl)-4-isopropylbenzamide

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

개요

Mesendogen is a TRPM6 inhibitor. Mesendogen enhances the mesoderm and definitive endoderm (DE) differentiations of human embryonic stem cells (hESCs) and human induced pluripotent stem cells (hiPSCs). Mesendogen can be used for the research of magnesium homeostasis during early embryonic cell development.

In Vitro（for reference only）

Mesendogen (10 μM) induces hESC mesoderm and endoderm differentiation, and decreases the level of neural differentiation markers.

Mesendogen (2.5, 10 and 25 μM; overnight) dose-dependently reduces intracellular magnesium level in H1 hESCs.

Mesendogen (10 μM; 7 days) inhibits the neural differentiation activity induced by Dorsomorphin.

Western Blot Analysis

Cell Line: H9 hESCs

Concentration: 10 μM

Incubation Time: 7 days

Result: Downregulated expression levels of pluripotency markers OCT4 and SOX2.

Form:Solid

Specifications

동의어

N-((2-Chloro-5-(trifluoromethyl)phenyl)carbamothioyl)-4-isopropylbenzamide

사양 및 순도

Moligand™, ≥98%

생화학 및 생리적 메커니즘

Mesendogen is a TRPM6 inhibitor. Mesendogen enhances the mesoderm and definitive endoderm (DE) differentiations of human embryonic stem cells (hESCs) and human induced pluripotent stem cells (hiPSCs). Mesendogen can be used for the research of magnesium h

보관 조건

Store at -20°C

배송

Ice chest + Ice pads

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등급

Moligand™

작업 유형

INHIBITOR

순수함

≥98%

이름과 식별자

• 정식 스마일: CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl
• IUPAC Name: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]-4-propan-2-ylbenzamide
• InChIKey: VVFIVYCBLSSVEK-UHFFFAOYSA-N
• INCHI: 1S/C18H16ClF3N2OS/c1-10(2)11-3-5-12(6-4-11)16(25)24-17(26)23-15-9-13(18(20,21)22)7-8-14(15)19/h3-10H,1-2H3,(H2,23,24,25,26)
• 이성체 SMILES: CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl
• PubChem CID: 2173015
• 분자량: 400.85

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass N-phenylthioureas

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: N-phenylthioureas
• Intermediate Tree Nodes: Not available
• Direct Parent: N-acyl-phenylthioureas
• Alternative Parents: Trifluoromethylbenzenes Aromatic monoterpenoids Monocyclic monoterpenoids Phenylpropanes Benzoic acids and derivatives Cumenes Benzoyl derivatives Chlorobenzenes Aryl chlorides Thioureas Carboxylic acids and derivatives Organochlorides Organic oxides Organonitrogen compounds Hydrocarbon derivatives Organooxygen compounds Alkyl fluorides Organopnictogen compounds Organofluorides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: N-acyl-phenylthiourea - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Trifluoromethylbenzene - Monoterpenoid - Benzoic acid or derivatives - Cumene - Phenylpropane - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Thiourea - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organofluoride - Alkyl halide - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as n-acyl-phenylthioureas. These are thiourea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.
• External Descriptors: Not available

Data sources

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

화학 및 물리적 특성

• 감도: Moisture sensitive
• 분자량: 400.800 g/mol
• XLogP3: 6.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 400.062 Da
• Monoisotopic Mass: 400.062 Da
• Topological Polar Surface Area: 73.200 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 507.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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