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SML4105

Cenicriviroc mesylate

≥98% (HPLC)

Synonym(s):

(-)-8-[4-(2-Butoxyethoxy)phenyl]-1-isobutyl-N-[4-[[(1-propyl-1H-imidazol-5-yl)methyl]sulfinyl]phenyl]-1,2,3,4-tetrahydro-1-benzazocine-5-carboxamide mesylate, 8-[4-(2-Butoxyethoxy)phenyl]-1,2,3,4-tetrahydro-1-(2-methylpropyl)-N-[4-[(S)-[(1-propyl-1H-imidazol-5-yl)methyl]sulfinyl]phenyl]-1-benzazocine-5-carboxamide mesylate, TAK-652 mesylate, TBR-652 mesylate

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About This Item

Empirical Formula (Hill Notation):
C41H52N4O4S·CH4O3S
CAS Number:
Molecular Weight:
793.05
NACRES:
NA.21
Assay:
≥98% (HPLC)
Form:
powder
Storage condition:
desiccated
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Quality Segment

assay

≥98% (HPLC)

form

powder

storage condition

desiccated

color

, faint green to green brown

solubility

DMSO: 2 mg/mL, clear

storage temp.

-10 to -25°C

SMILES string

OS(=O)(C)=O.CCCCOCCOC(C=C1)=CC=C1C2=CC=C3C(/C=C(C(NC4=CC=C([S@@+]([O-])CC5=CN=CN5CCC)C=C4)=O)\CCCN3CC(C)C)=C2

Biochem/physiol Actions

Orraly active inhibitor of CCR2 and CCR5 receptors; Antiretroviral entry inhibitor.

Cenicriviroc is an orally available inhibitor of C-C chemokine CCR2 (IC50 = 5.9 nM) and CCR5 (IC50 = 0.29 nM) receptors, an antiretroviral entry inhibitor with anti-inflammatory activity. CCR5 chemokine receptor antagonists are believed to inhibit HIV entry by blocking interaction of viral coat protein gp120 with the receptor. CCR2 is involved with inflammatory-related disease states.

Disclaimer

Hygroscopic


Storage Class

11 - Combustible Solids

WGK

WGK 3

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable



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