BD750 - 10mM in DMSO , CAS No.892686-59-8

CAS: 892686-59-8 Cat. No.: B426715 Summenformel: C₁₄H₁₃N₃OS Molekulargewicht: 271.34 EG-Nummer: 804-735-5 PubChem CID: 16459674

GRADE & PURITY 10mM in DMSO

Synonyms

2-(2-Benzothiazolyl)-4,5,6,7-tetrahydro-2H-indazol-3-ol | MS-23843 | STK241724 | STK615824 | 2-(1,3-benzothiazol-2-yl)-1,2,4,5,6,7-hexahydro-3H-indazol-3-one | 2-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazol-3-one | bd750 | AKOS005550035 | 2-(2-be

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Übersicht

Information

BD750 is an immunosuppressant and a dual inhibitor ofJAK3andSTAT5that inhibits IL-2-induced JAK3/STAT5-dependent T cell proliferation with IC50 of 1.5 μM and 1.1 μM for mouse and human T-cell proliferation, respectively.

Targets

JAK3 ; STAT5 ; human T-cell proliferation (Cell-based assay); mouse T-cell proliferation (Cell-based assay) ; 1.1 μM; 1.5 μM

Specifications

Synonyme

2-(2-Benzothiazolyl)-4,5,6,7-tetrahydro-2H-indazol-3-ol | MS-23843 | STK241724 | STK615824 | 2-(1,3-benzothiazol-2-yl)-1,2,4,5,6,7-hexahydro-3H-indazol-3-one | 2-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazol-3-one | bd750 | AKOS005550035 | 2-(2-be

Spezifikationen & Reinheit

10mM in DMSO

Biochemische und physiologische Mechanismen

BD750 is an immunosuppressant and a dual inhibitor of JAK3 and STAT5 that inhibits IL-2-induced JAK3/STAT5-dependent T cell proliferation with IC50 of 1.5 μM and 1.1 μM for mouse and human T-cell proliferation, respectively.

Storage

Store at -80°C

Verschickt in

Dry ice packs + Cold packs

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

INHIBITOR

Namen und Kennungen

• Pubchem Sid: 528763406
• Kanonisches Lächeln: C1CCC2=C(C1)C(=O)N(N2)C3=NC4=CC=CC=C4S3
• IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1H-indazol-3-one
• InChIKey: QWUHPPCZZXKXOQ-UHFFFAOYSA-N
• INCHI: 1S/C14H13N3OS/c18-13-9-5-1-2-6-10(9)16-17(13)14-15-11-7-3-4-8-12(11)19-14/h3-4,7-8,16H,1-2,5-6H2
• Isomere SMILES: C1CCC2=C(C1)C(=O)N(N2)C3=NC4=CC=CC=C4S3
• WGK Deutschland: 3
• PubChem CID: 16459674
• Molekulargewicht: 271.34

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Benzothiazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Benzothiazoles
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzothiazoles
• Alternative Parents: Pyrazolones Benzenoids Vinylogous amides Thiazoles Pyrazoles Heteroaromatic compounds Lactams Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1,3-benzothiazole - Pyrazolinone - Benzenoid - Azole - Pyrazole - Thiazole - Vinylogous amide - Heteroaromatic compound - Lactam - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 271.340 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 271.078 Da
• Monoisotopic Mass: 271.078 Da
• Topological Polar Surface Area: 73.500 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 436.000
• 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