2-(2-{[(4-Chlorophenyl)thio]methyl}-phenoxy)ethanohydrazide - ≥97% , CAS No.175202-85-4

CAS: 175202-85-4 Cat. No.: C300027 Formula: C₁₅H₁₅ClN₂O₂S Peso molecolare: 322.82 PubChem CID: 2778909

GRADE & PURITY ≥97%

Synonyms

Oprea1_597987 | 2-[2-[(4-chlorophenyl)sulfanylmethyl]phenoxy]acetohydrazide | HMS555K11 | 2-(2-{[(4-chlorophenyl)thio]methyl}phenoxy)ethanohydrazide | 2-(2-{[(4-Chlorophenyl)thio]methyl}-phenoxy)ethanohydrazide | MFCD00052139 | 2-(2-{[(4-chlorophenyl)sulf

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

Oprea1_597987 | 2-[2-[(4-chlorophenyl)sulfanylmethyl]phenoxy]acetohydrazide | HMS555K11 | 2-(2-{[(4-chlorophenyl)thio]methyl}phenoxy)ethanohydrazide | 2-(2-{[(4-Chlorophenyl)thio]methyl}-phenoxy)ethanohydrazide | MFCD00052139 | 2-(2-{[(4-chlorophenyl)sulf

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

Sorrisi canonici

C1=CC=C(C(=C1)CSC2=CC=C(C=C2)Cl)OCC(=O)NN

IUPAC Name

2-[2-[(4-chlorophenyl)sulfanylmethyl]phenoxy]acetohydrazide

InChIKey

OZJNLFBIXACHOQ-UHFFFAOYSA-N

INCHI

1S/C15H15ClN2O2S/c16-12-5-7-13(8-6-12)21-10-11-3-1-2-4-14(11)20-9-15(19)18-17/h1-8H,9-10,17H2,(H,18,19)

Isomeri SMILES

C1=CC=C(C(=C1)CSC2=CC=C(C=C2)Cl)OCC(=O)NN

PubChem CID

2778909

Peso molecolare

322.82

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Thiophenol ethers Phenoxy compounds Chlorobenzenes Alkylarylthioethers Alkyl aryl ethers Aryl chlorides Carboxylic acid hydrazides Sulfenyl compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Aryl thioether - Thiophenol ether - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid hydrazide - Carboxylic acid derivative - Sulfenyl compound - Thioether - Ether - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• 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

Obiettivi associati (non umani)

Plasmodium berghei (192651 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Peso molecolare: 322.800 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 322.054 Da
• Monoisotopic Mass: 322.054 Da
• Topological Polar Surface Area: 89.700 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 325.000
• 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

Domande frequenti

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 175202-85-4, the molecular formula is C15H15ClN2O2S, and the molecular weight is 322.82 g/mol. InChIKey OZJNLFBIXACHOQ-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.