ChemicalBook--->CAS DataBase List--->185991-07-5

185991-07-5

185991-07-5 Structure

185991-07-5 Structure
IdentificationBack Directory
[Name]

AMD 3465 (*Hexahydrobromide*)
[CAS]

185991-07-5
[Synonyms]

CS-810
AMD 3465
AMD3465,98%
GENZ-644494
AMD 3465 (hydrobroMide)
AMD3465;AMD-3465;AMD 3465
AMD 3465 (*Hexahydrobromide*)
AMD3465 R10406hexahydrobromide
1-(2-Pyridinyl)-N-[4-(1,4,8,11-tetraazacyclotetradecan-1-ylMethyl)benzyl]MethanaMine
N-[[4-(1,4,8,11-Tetraazacyclotetradec-1-ylmethyl)phenyl]methyl]-2-pyridinemethanamine hexahydrobromide
[Molecular Formula]

C24H38N6
[MDL Number]

MFCD20926342
[MOL File]

185991-07-5.mol
[Molecular Weight]

410.599
Chemical PropertiesBack Directory
[Melting point ]

>200°C (dec.)
[storage temp. ]

-20°C
[solubility ]

DMSO (Slightly), Methanol (Very Slightly), Water (Slightly)
[form ]

powder
[color ]

white to light brown
[Water Solubility ]

H2O: 25mg/mL, clear
[InChI]

1S/C24H38N6/c1-2-13-29-24(5-1)20-28-19-22-6-8-23(9-7-22)21-30-17-4-12-26-15-14-25-10-3-11-27-16-18-30/h1-2,5-9,13,25-28H,3-4,10-12,14-21H2
[InChIKey]

CWJJHESJXJQCJA-UHFFFAOYSA-N
[SMILES]

N3(CCNCCCNCCNCCC3)Cc1ccc(cc1)CNCc2ncccc2
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

AMD 3465 is a CXCR4 antagonist and in combination with monoclonal antibody, was shown to be potentially effective in reducing tumor growth and increasing survival in patient with B cell lymphoma
[Biochem/physiol Actions]

AMD3465 is also termed as{N-[1,4,8,11-tetraazacyclotetradecanyl-1,4-phenylenebis(methylene)]-2-(aminomethyl)pyridine}. It controls oncogenic signaling and invasiveness in vitro. It inhibits breast cancer growth and metastasis in vivo. As a chemokine receptor 4 (CXCR4) antagonist, AMD3465 is ten times more efficient than bicyclam AMD3100.
[in vivo]

AMD 3465 (2.5 mg/kg/d, s.c. for 5 weeks) significantly blocks the growth of U87 GBM and Daoy xenografts[2].

[IC 50]

12G5 mAb-CXCR4: 0.75 nM (IC50, in SupT1 cells); CXCL12AF647-CXCR4: 18 nM (IC50, in SupT1 cells); X4 HIV-1 (NL4.3): 6.1 nM (IC50, in MT-4 cells); X4 HIV-1 (RF): 7.4 nM (IC50, in MT-4 cells); X4 HIV-1 (HE): 9.8 nM (IC50, in MT-4 cells); X4 HIV-1 (IIIB): 12.3 nM (IC50, in MT-4 cells); X4 HIV-1 (NL4.3AMD3100): 2822 nM (IC50, in MT-4 cells); HIV-2 (ROD): 12.3 nM (IC50, in MT-4 cells); HIV-2 (EHO): 12.3 nM (IC50, in MT-4 cells)
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

AMD 3465 (*Hexahydrobromide*)(185991-07-5)1HNMR
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