ChemicalBook--->CAS DataBase List--->603987-59-3

603987-59-3

603987-59-3 Structure

603987-59-3 Structure
IdentificationBack Directory
[Name]

CBRCULCCRGSSLB-UHFFFAOYSA-N
[CAS]

603987-59-3
[Synonyms]

Ty-51469
TY 51469,TY51469
CBRCULCCRGSSLB-UHFFFAOYSA-N
[Molecular Formula]

C20H15FN2O6S4
[MDL Number]

MFCD16628177
[MOL File]

603987-59-3.mol
[Molecular Weight]

526.6
Chemical PropertiesBack Directory
[Melting point ]

257-258 °C
[Boiling point ]

818.8±75.0 °C(Predicted)
[density ]

1.620±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

Soluble in DMSO
[form ]

Solid
[pka]

3.30±0.10(Predicted)
[color ]

Off-white to light brown
[InChIKey]

CBRCULCCRGSSLB-UHFFFAOYSA-N
[SMILES]

FC1=CC2=C(C=C1)SC(S(NC3=CC=C(C=C3S(C)(=O)=O)C4=NC(C(O)=O)=CS4)(=O)=O)=C2C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

TY-51469 is a chymase inhibitor with IC50s for simian and human chymases of 0.4 and 7.0 nM, respectively.
[Biological Activity]

TY-51469 is a potent and selective chymase inhibitor th at prevents development and progression of non-alcoholic steatohepatitis in rats. TY-51469 inhibits activation of intestinal MMP-9 and prevents intestinal damage in indomethacin-induced small intestinal damage in rats. Also TY-51469 might protect against pancreatic islet disorganization.
[in vivo]

TY-51469 shows 100% stability in rat plasma at 40°C for as long as 1 hour[1]. TY-51469 suppresses the accumulation of neutrophils in the lung and reduces silica-induced pulmonary fibrosis in mice[2].

[References]

[1] Takato H, et al. The specific chymase inhibitor TY-51469 suppresses the accumulation of neutrophils in the lung and reduces silica-induced pulmonary fibrosis in mice. Expert Opinion on Therapeutic Targets Volume 15, 2011 - Issue 4.
Spectrum DetailBack Directory
[Spectrum Detail]

CBRCULCCRGSSLB-UHFFFAOYSA-N(603987-59-3)1HNMR
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