CAS 23155-00-2 4'-Hydroxyglibenclamide (HCID 3082214)

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기본 정보

CAS: 23155-00-2
표준 SMILES: COc1ccc(Cl)cc1C(=O)NCCc1ccc(S(=O)(=O)NC(=O)NC2CCC(O)CC2)cc1
InChIKey: IUWSGCQEWOOQDN-UHFFFAOYSA-N
분자식: C23H28ClN3O6S
평균 분자량: 510 g/mol
단동위원소 질량: 509.1387345

개요

Trans-4-Hydroxyglyburide is a sulfonamide.

이름 및 식별자

우선 이름: 4'-Hydroxyglibenclamide
IUPAC: 5-chloro-N-[2-[4-[(4-hydroxycyclohexyl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide
현지명: ractrans-4-하이드록시글리부라이드
영어명: rac trans-4-Hydroxy Glyburide
분자식: C23H28ClN3O6S
분자량: 510

이름 및 동의어

4-Hydroxyglibenclamide23155-04-64'-HydroxyglibenclamideF52YNT7U67DTXSID10177737Benzamide, 5-chloro-N-[2-[4-[[[[(4-hydroxycyclohexyl)amino]carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxy-Benzamide, 5-chloro-N-(2-(4-(((((4-hydroxycyclohexyl)amino)carbonyl)amino)sulfonyl)phenyl)ethyl)-2-methoxy-RefChem:534919DTXCID7010022823155-00-2rac trans-4-Hydroxy Glyburiderac cis-4-Hydroxy Glyburide

이름 더 보기

ractrans-4-하이드록시글리부라이드Glyburide trans-4-HydroxycyclohexylGlibenclamide trans-4-Hydroxycyclohexyltrans-1-[[p-[2-(5-Chloro-o-anisaMido)ethyl]phenyl] sulfonyl]-3-(4-hydroxycyclohexyl)ureaN-[4-[β-(2-Methoxy-5-chlorobenzaMido)ethyl] benzenesulfonyl]-N'-(trans-4-hydroxycyclohexyl)urea5-Chloro-N-[2-[4-[[[[(trans-4-hydroxycyclohexyl)aMino]carbonyl]aMino]sulfonyl]phenyl]ethyl]-2-MethoxybenzaMideBenzamide, 5-chloro-N-[2-[4-[[[[(trans-4-hydroxycyclohexyl)amino]carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxy-

물성

구조 계산 물성

XLogP: 3.7
극성 표면적: 142 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 6
회전 가능 결합 수: 8
무거운 원자 수: 34
형식 전하: 0
복잡도: 776

물리화학적 성질

녹는점: 184 · 184-186 °C(Solvent: Ethanol)
밀도: 1.414 · 1.414±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
저장 조건: -20 °C · Hygroscopic, -20°C Freezer, Under Inert Atmosphere
용해도: DMSO: slightly soluble,Methanol: slightly soluble
물리적 상태: 고체
산도 계수 (pKa): 5.17 · 5.170±0.10(predicted)
안정성: 흡습성 및 습기에 민감함

화학적 성질

White Solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

화학 및 산업

약리 정보

Metabolism/Metabolites4-cis-hydroxycyclohexyl glyburide is a known human metabolite of Glyburide.

응용 분야

용도rac trans-4-Hydroxy Glyburide is a metabolite of Glyburide which is used as an antidiabetic.

공급사3 곳

BOC Sciences16314854226 · [email protected]

深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]

梯尔希（南京）药物研发有限公司18012923235 · [email protected]

화합물 노트

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ractrans-4-하이드록시글리부라이드