테멜라스틴

Temelastine

HCID 55482CAS 86181-42-2

기본 정보

표준 SMILES
Cc1ccc(Cc2cnc(NCCCCc3ncc(Br)cc3C)[nH]c2=O)cn1
InChIKey
OGEAASSLWZDQBM-UHFFFAOYSA-N
분자식
C21H24BrN5O
평균 분자량
442.4 g/mol
단동위원소 질량
441.11642249

개요

Temelastine is a pyrimidone.

이름 및 식별자

우선 이름
Temelastine
IUPAC
2-[4-(5-bromo-3-methyl-2-pyridinyl)butylamino]-5-[(6-methyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one
현지명
테멜라스틴
영어명
Temelastine
분자식
C21H24BrN5O
분자량
442.359

이름 및 동의어

TEMELASTINE86181-42-2TemelastinaTemelastinumSK&F 93944SK&F-93944BF6IGI53XHDTXSID602354374(1H)-Pyrimidinone, 2-((4-(5-bromo-3-methyl-2-pyridinyl)butyl)amino)-5-((6-methyl-3-pyridinyl)methyl)-SKF 93944RefChem:932696DTXCID60157928
이름 더 보기
테멜라스틴SKF-939442-[[4-(5-Bromo-3-methyl-2-pyridinyl)butyl]amino]-5-[(6-methyl-3-pyridinyl)methyl]-4(1H)-pyrimidinone
2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-oneTemelastinum [Latin]Temelastina [Spanish]UNII-BF6IGI53XHTemelastine [USAN:INN:BAN]TEMELASTINE [INN]Temelastine (USAN/INN)TEMELASTINE [USAN]

데이터베이스 식별자

CAS
86181-42-2
PubChem CID
55482
DTXSID
DTXSID60235437
ChEMBL
CHEMBL70598
ChEBI
CHEBI:180882
UNII
BF6IGI53XH
Nikkaji
J23.727B

물성

구조 계산 물성

XLogP
3.7
극성 표면적
79.3 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
8
무거운 원자 수
28

실험 및 물리화학적 성질

LogP3.19

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 1건

Drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine. Included here are the classical antihistaminics that antagonize or prevent the action of histamine mainly in immediate hypersensitivity. They act in the bronchi, capillaries, and some other smooth muscles, and are used to prevent or allay motion sickness, seasonal rhinitis, and allergic dermatitis and to induce somnolence. The effects of blocking central nervous system H1 receptors are not as well understood.

Metabolite PathwaysTemelastine H1-Antihistamine Action

응용 분야

용도Antihistaminic.

공급사2 곳

上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]

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4건

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