MoTP - Moligand™, ≥98% , CAS No.57055-82-0

CAS: 57055-82-0 Cat. No.: M275462 Molecular Weight: 267.39

GRADE & PURITY Moligand™, ≥98%

Synonyms

4-(4-Morpholinobutylthio)phenol | 4-{[4-(MORPHOLIN-4-YL)BUTYL]SULFANYL}PHENOL | MoTP, >=98% (HPLC) | 4-(4-morpholin-4-ylbutylsulfanyl)phenol | HY-114745 | SCHEMBL11529117 | CBDivE_010514 | MoTP | AKOS000560293 | DTXSID70389177 | MFCD00642470 | 4-[[4-(4-MO

Storage

Store at -20°C,Argon charged,Desiccated

Shipped In

Ice chest + Ice pads

Overview

MoTP is a specific platelet activating factor receptor antagonist and can induce melanocyte ablation. MoTP can be used for the research of cancer.

Specifications

Synonyms

4-(4-Morpholinobutylthio)phenol | 4-{[4-(MORPHOLIN-4-YL)BUTYL]SULFANYL}PHENOL | MoTP, >=98% (HPLC) | 4-(4-morpholin-4-ylbutylsulfanyl)phenol | HY-114745 | SCHEMBL11529117 | CBDivE_010514 | MoTP | AKOS000560293 | DTXSID70389177 | MFCD00642470 | 4-[[4-(4-MO

Specifications & Purity

Moligand™, ≥98%

Biochemical and Physiological Mechanisms

Specific platelet activating factor (PAF)-receptor antagonist (IC 50 = 0.28 μM). PLC inhibitor (IC 50 = 1.05 μM). PAF-induced hypotension inhibitor. Active in vivo and in vitro .

Storage

Store at -20°C, Argon charged, Desiccated

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

ANTAGONIST

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: C1COCCN1CCCCSC2=CC=C(C=C2)O
• IUPAC Name: 4-(4-morpholin-4-ylbutylsulfanyl)phenol
• InChIKey: YHKNLUTUXZDOQI-UHFFFAOYSA-N
• INCHI: 1S/C14H21NO2S/c16-13-3-5-14(6-4-13)18-12-2-1-7-15-8-10-17-11-9-15/h3-6,16H,1-2,7-12H2
• Isomeric SMILES: C1COCCN1CCCCSC2=CC=C(C=C2)O
• Molecular Weight: 267.39
• Reaxy-Rn: 986799
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=986799&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Class Thioethers
      • Subclass Aryl thioethers

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Class: Thioethers
• Subclass: Aryl thioethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Aryl thioethers
• Alternative Parents: Thiophenol ethers Alkylarylthioethers 1-hydroxy-2-unsubstituted benzenoids Morpholines Benzene and substituted derivatives Trialkylamines Sulfenyl compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl thioether - Thiophenol ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkylarylthioether - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxygen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.
• 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

Chemical and Physical Properties

• Solubility: Soluble in DMSO to 25 mM and in ethanol to 25 mM
• Sensitivity: light sensitive
• Molecular Weight: 267.390 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 267.129 Da
• Monoisotopic Mass: 267.129 Da
• Topological Polar Surface Area: 58.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 214.000
• 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