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T7330

Teijin compound 1 hydrochloride

Name: Teijin compound 1 hydrochloride
Brand: SIGMA

≥98% (HPLC), powder

别名:

N-[2-[[(3R)-1-[(4-chlorophenyl)methyl]-3-pyrrolidinyl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide hydrochloride

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关于此项目

经验公式（希尔记法）:

C₂₁H₂₁ClF₃N₃O₂·HCl

化学文摘社编号:

1313730-14-1

分子量:

476.32

NACRES:

NA.77

PubChem Substance ID:

329826865

UNSPSC Code:

51111800

MDL number:

MFCD16618399

Assay:

≥98% (HPLC)

Form:

powder

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assay

≥98% (HPLC)

form

powder

color

white to tan

solubility

DMSO: ≥20 mg/mL

storage temp.

2-8°C

SMILES string

Cl.FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@@H]2CCN(C2)Cc3ccc(Cl)cc3

InChI

1S/C21H21ClF3N3O2.ClH/c22-17-6-4-14(5-7-17)12-28-9-8-18(13-28)27-19(29)11-26-20(30)15-2-1-3-16(10-15)21(23,24)25;/h1-7,10,18H,8-9,11-13H2,(H,26,30)(H,27,29);1H/t18-;/m1./s1

InChI key

PGUQBBISBKGQDC-GMUIIQOCSA-N

Application

Studies have reported that Trp98^2.60, Thr292^7.40, His121^3.33 and Ile263^6.55 of Teijin compound 1 significantly affect the antagonistic functions of the compound at CCR2.

Biochem/physiol Actions

Teijin compound 1 is CCR2b receptor antagonist

Teijin compound 1 is CCR2b receptor antagonist. Teijin compound 1 inhibits cell chemotaxis induced by MCP-1. The chemokine receptors CCR2 is G protein-coupled receptors (GPCR), and is mainly expressed in monocytes, immature dendritic cells, activated T-lymphocytes and basophils.

Preparation Note

Teijin compound 1 hydrochloride is soluble in DMSO at a concentration that is greater than or equal to 20 mg/ml.

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

法规信息

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历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

031M4722V

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Elucidation of binding sites of dual antagonists in the human chemokine receptors CCR2 and CCR5.

Spencer E Hall et al.

Molecular pharmacology, 75(6), 1325-1336 (2009-03-20)

Design of dual antagonists for the chemokine receptors CCR2 and CCR5 will be greatly facilitated by knowledge of the structural differences of their binding sites. Thus, we computationally predicted the binding site of the dual CCR2/CCR5 antagonist N-dimethyl-N-[4-[[[2-(4-methylphenyl)-6,7-dihydro-5H-benzohepten-8-yl] carbonyl]amino]benzyl]tetrahydro-2H-pyran-4-aminium (TAK-779)

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全球贸易项目编号

货号	GTIN
T7330-5MG	04061833226919
T7330-25MG	04061832277028

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