Diazoxide - Moligand™, 10mM in DMSO , Activator of K ir6.1;Activator of K ir6.2, CAS No.364-98-7, Activator of K ir6.1;Activator of K ir6.2

CAS: 364-98-7 Cat. No.: D423637 분자식: C₈H₇ClN₂O₂S 분자량: 230.67 EC 번호: 206-668-1

GRADE & PURITY Moligand™, 10mM in DMSO

Synonyms

diazoxide|364-98-7|Proglycem|Hyperstat|Hypertonalum|Eudemine|Proglicem|Dizoxide|Mutabase|7-Chloro-3-methyl-2H-1,2,4-benzothiadiazine 1,1-dioxide|Diazossido|Diazoxidum|Sch 6783|Sch-6783|Diazoxido|SRG 95213|SRG-95213|C8H7ClN2O2S|Eudemine injection|2H-1,2,4-

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

동의어

diazoxide | 364-98-7 | Proglycem | Hyperstat | Hypertonalum | Eudemine | Proglicem | Dizoxide | Mutabase | 7-Chloro-3-methyl-2H-1,2,4-benzothiadiazine 1,1-dioxide | Diazossido | Diazoxidum | Sch 6783 | Sch-6783 | Diazoxido | SRG 95213 | SRG-95213 | C8H7ClN2O2S | Eudemine injection | 2H-1,2,4-

사양 및 순도

Moligand™, 10mM in DMSO

생화학 및 생리적 메커니즘

Selective K IR 6.x (K ATP ) activator; antihypertensive.

보관 조건

Store at -80°C

배송

Dry ice packs + Cold packs

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등급

Moligand™

작업 유형

ACTIVATOR

작동 메커니즘

Activator of K ir6.1;Activator of K ir6.2

이름과 식별자

• Pubchem Sid: 528769653
• 정식 스마일: CC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)Cl
• IUPAC Name: 7-chloro-3-methyl-4H-1λ6,2,4-benzothiadiazine 1,1-dioxide
• InChIKey: GDLBFKVLRPITMI-UHFFFAOYSA-N
• INCHI: 1S/C8H7ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-4H,1H3,(H,10,11)
• 이성체 SMILES: CC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)Cl
• WGK 독일: 3
• RTECS: DK8185000
• 분자량: 230.67
• Reaxy-Rn: 523846
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=523846&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 분류 Thiadiazines
      • Subclass Benzothiadiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Thiadiazines
• Subclass: Benzothiadiazines
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,2,4-benzothiadiazine-1,1-dioxides
• Alternative Parents: Imidolactams Benzenoids Aryl chlorides Organosulfonic acids and derivatives Azacyclic compounds Amidines Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1,2,4-benzothiadiazine-1,1-dioxide - Aryl chloride - Aryl halide - Benzenoid - Imidolactam - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azacycle - Amidine - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as 1,2,4-benzothiadiazine-1,1-dioxides. These are aromatic heterocyclic compounds containing a 1,2,4-benzothiadiazine ring system with two S=O bonds at the 1-position.
• External Descriptors: sulfone - organochlorine compound - benzothiadiazine

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(인간)

KCNJ11 Tclin ATP-sensitive inward rectifier potassium channel 11 (1 Activities)

Discover Target: KCNJ11

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

화학 및 물리적 특성

• 감도: Heat sensitive
• 녹는점(°C): 332 °C
• 분자량: 230.670 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 229.992 Da
• Monoisotopic Mass: 229.992 Da
• Topological Polar Surface Area: 66.900 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 360.000
• 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

참고 문헌

1. Panqin Ma, Zheng Luo, Qi Wang, Ying Chen, Feng Liu, Changliang Ren, Caisheng Wu, Zibiao Li, Yun-Long Wu.  (2024)  Combined activation of artificial and natural ion channels for disrupting mitochondrial ion homeostasis towards effective postoperative tumor recurrence and metastasis suppression.  Theranostics,      [PMID:38855179] [10.7150/thno.94855]