GR127935 hydrochloride - ≥98%(HPLC) , CAS No.148642-42-6

Name: GR127935 hydrochloride - ≥98%(HPLC) , CAS No.148642-42-6
Brand: Aladdin Scientific
SKU: G167404
Availability: InStock

CAS: 148642-42-6 Cat. No.: G167404 분자식: C₂₉H₃₂ClN₅O₃ 분자량: 534.05

COA

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GR127935 hydrochloride - ≥98%(HPLC) CAS No(148642-42-6) by Aladdin Scientific

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주문 가능

등급 & 순도 ≥98%(HPLC)

Synonyms

BG177433 | GR127935 (hydrochloride) | SR-01000076115 | HY-100794 | SR-01000076115-1 | LP00790 | N-(4-methoxy-3-(4-methylpiperazin-1-yl)phenyl)-2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)biphenyl-4-carboxamide hydrochloride | CCG-222094 | GR 127935 hydroc

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

개요 사양 이름과 식별자 문서 고급 데이터 Taxonomic Classification 3D 구조 관련 대상(인간) 관련 대상(비인간) 작용 메커니즘 인증서(CoA, COO, BSE/TSE 및 분석 차트) 화학 및 물리적 특성 자주 묻는 질문과 기사 솔루션 계산기 리뷰

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이 등급을 선택하는 이유

≥98%(HPLC) 최소한의 기준선 간섭이 필요한 민감한 크로마토그래피 및 분석 워크플로우용.

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보관 및 배송

Store at -20°C Ice chest + Ice pads 출고. 정확한 사양은 로트별 COA를 확인하세요.

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품질 문서

SDS, COA, 데이터시트, 사양서를 다운로드할 수 있습니다. 로트별 COA는 로트 번호 조회를 통해 확인할 수 있습니다.

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문헌적 근거

크로마토그래피, 유기 합성 및 교차 커플링 반응 분야의 동료 심사 논문 0편에서 인용되었습니다.

개요

GR127935 hydrochloride is a potent and orally active 5-HT1D and 5-HT1B receptor antagonist with pKis of 8.5 for both isoforms. GR127935 hydrochloride has 100-fold selectivity for 5-HT1B/1D receptors over 5-HT1A, 5-HT2A, and 5-HT2C receptors. GR127935 hydrochloride can be used in neurological disease research。

사양

동의어

사양 및 순도

≥98%(HPLC)

생화학 및 생리적 메커니즘

Potent and selective 5-HT 1B/ 1D receptor antagonist (pK i = 8.5 for both 5-HT 1D in rat and 5-HT 1D in guinea pig). 100-fold selectivity over 5-HT 1A , 5-HT 1E , and 5-HT 2C . Displays centrally mediated effects upon systemic administration.

보관 조건

Store at -20°C

배송

Ice chest + Ice pads

이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.

작업 유형

ANTAGONIST

참고

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.

순수함

≥98%(HPLC)

이름과 식별자

Pubchem Sid

528764638

정식 스마일

CC1=C(C=CC(=C1)C2=NOC(=N2)C)C3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)OC)N5CCN(CC5)C.Cl

IUPAC Name

N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-4-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide;hydrochloride

InChIKey

SRVVUYIJVBLEJI-UHFFFAOYSA-N

INCHI

1S/C29H31N5O3.ClH/c1-19-17-23(28-30-20(2)37-32-28)9-11-25(19)21-5-7-22(8-6-21)29(35)31-24-10-12-27(36-4)26(18-24)34-15-13-33(3)14-16-34;/h5-12,17-18H,13-16H2,1-4H3,(H,31,35);1H

이성체 SMILES

CC1=C(C=CC(=C1)C2=NOC(=N2)C)C3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)OC)N5CCN(CC5)C.Cl

대체 CAS

148672-13-3

분자량

534.05

Reaxy-Rn

8530522

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8530522&ln=

문서

📋 안전 데이터 시트(SDS)

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✅ 분석 성적서(COA)

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고급 데이터

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - 분류 Benzene and substituted derivatives
    - Subclass Anilides
      - Level5 Aromatic anilides
        Level6 Benzanilides

Kingdom	Organic compounds
Superclass	Benzenoids
분류	Benzene and substituted derivatives
Subclass	Anilides
Intermediate Tree Nodes	Aromatic anilides
Direct Parent	Benzanilides
Alternative Parents	Biphenyls and derivatives Phenylpiperazines N-arylpiperazines Phenyloxadiazoles Aminophenyl ethers Benzamides Methoxyanilines Anisoles Benzoyl derivatives Dialkylarylamines Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Toluenes N-methylpiperazines Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Oxacyclic compounds Hydrochlorides Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Benzanilide - Phenylpiperazine - N-arylpiperazine - Biphenyl - Phenyl-1,2,4-oxadiazole - Aminophenyl ether - Methoxyaniline - Benzoic acid or derivatives - Benzamide - Tertiary aliphatic/aromatic amine - Benzoyl - Methoxybenzene - Anisole - Phenol ether - Aniline or substituted anilines - Phenoxy compound - Dialkylarylamine - Alkyl aryl ether - Toluene - N-methylpiperazine - N-alkylpiperazine - Piperazine - 1,4-diazinane - Oxadiazole - Azole - 1,2,4-oxadiazole - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Oxacycle - Organic oxygen compound - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organopnictogen compound - Aromatic heteromonocyclic compound
설명	This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
External Descriptors	hydrochloride
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

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리뷰

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Lot Number	Certificate Type	날짜	항목
B2423831	Certificate of Analysis	Jan 16, 2024	G167404
B2423874	Certificate of Analysis	Jan 16, 2024	G167404
B2423877	Certificate of Analysis	Jan 16, 2024	G167404
B2423894	Certificate of Analysis	Jan 16, 2024	G167404
B2423895	Certificate of Analysis	Jan 16, 2024	G167404
B2423905	Certificate of Analysis	Jan 16, 2024	G167404
B2423906	Certificate of Analysis	Jan 16, 2024	G167404
B2423913	Certificate of Analysis	Jan 16, 2024	G167404

감도	Moisture sensitive
분자량	534.000 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	533.219 Da
Monoisotopic Mass	533.219 Da
Topological Polar Surface Area	83.700 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	739.000
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	2