Beclamide - ≥98% , CAS No.501-68-8

CAS: 501-68-8 Cat. No.: B136633 분자식: C₁₀H₁₂ClNO 분자량: 197.666 EC 번호: 207-927-1

GRADE & PURITY ≥98%

Synonyms

Beclamide [INN:BAN:DCF] | BECLAMIDE [MI] | BRN 2720702 | D07300 | EINECS 207-927-1 | Hibicon | Beclamide 1.0 mg/ml in Acetonitrile | CAS-501-68-8 | WLN: G2VM1R | Pharmakon1600-01505827 | Posedran | Q3637399 | Khlorakon | Chlorakon | AS-36373 | HY-B1185 |

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

동의어

Beclamide [INN:BAN:DCF] | BECLAMIDE [MI] | BRN 2720702 | D07300 | EINECS 207-927-1 | Hibicon | Beclamide 1.0 mg/ml in Acetonitrile | CAS-501-68-8 | WLN: G2VM1R | Pharmakon1600-01505827 | Posedran | Q3637399 | Khlorakon | Chlorakon | AS-36373 | HY-B1185 |

사양 및 순도

≥98%

생화학 및 생리적 메커니즘

Beclamide is a drug that possesses anticonvulsant activity, has been used as an anticonvulsant.

보관 조건

Store at -20°C

배송

Ice chest + Ice pads

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순수함

≥98%

제품 특성

ALogP

1.7

이름과 식별자

Pubchem Sid

504751940

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751940

정식 스마일

C1=CC=C(C=C1)CNC(=O)CCCl

IUPAC Name

N-benzyl-3-chloropropanamide

InChIKey

JPYQFYIEOUVJDU-UHFFFAOYSA-N

INCHI

1S/C10H12ClNO/c11-7-6-10(13)12-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13)

이성체 SMILES

C1=CC=C(C=C1)CNC(=O)CCCl

분자량

197.666

Reaxy-Rn

2720702

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2720702&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Secondary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alkyl halide - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• 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

관련 대상(비인간)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

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

Mus musculus (284745 Activities)

Explore this target

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

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

작용 메커니즘

화학 및 물리적 특성

• 용해성: DMSO : ≥ 100 mg/mL (505.92 mM)；H2O : 0.67 mg/mL (3.39 mM; Need ultrasonic)
• 분자량: 197.660 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 197.061 Da
• Monoisotopic Mass: 197.061 Da
• Topological Polar Surface Area: 29.100 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 155.000
• 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

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 501-68-8, the molecular formula is C10H12ClNO, and the molecular weight is 197.666 g/mol. InChIKey JPYQFYIEOUVJDU-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.