ChemicalBook--->CAS DataBase List--->423735-93-7

423735-93-7

423735-93-7 Structure

423735-93-7 Structure
IdentificationBack Directory
[Name]

ML 161
[CAS]

423735-93-7
[Synonyms]

ML 161
CS-1106
ML161;ML-161
ML161, >=98%
Parmodulin 2
ML161 (Parmodulin 2)
2-Bromo-N-(3-butanamidophenyl)benzamide
2-BroMo-N-(3-butyraMidophenyl)benzaMide
2-BroMo-N-[3-[(1-oxobutyl)aMino]phenyl]benzaMide
Benzamide, 2-bromo-N-[3-[(1-oxobutyl)amino]phenyl]-
ML 161 2-Bromo-N-[3-[(1-oxobutyl)amino]phenyl]benzamide
[EINECS(EC#)]

803-969-5
[Molecular Formula]

C17H17BrN2O2
[MDL Number]

MFCD03063772
[MOL File]

423735-93-7.mol
[Molecular Weight]

361.233
Chemical PropertiesBack Directory
[Boiling point ]

465.7±30.0 °C(Predicted)
[density ]

1.441±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO: soluble5mg/mL (clear solution)
[form ]

powder
[pka]

12.37±0.70(Predicted)
[color ]

white to beige
Safety DataBack Directory
[RIDADR ]

UN 3077 9 / PGIII
[WGK Germany ]

3
Hazard InformationBack Directory
[Description]

ML-161 is an allosteric, reversible inhibitor of proteinase-activated receptor 1 (PAR1) on platelets, preventing surface expression of P-selectin induced by the peptide SFLLRN with an IC50 value of 0.26 μM. It blocks platelet activation induced by thrombin as well as by SFLLRN but not by PMA , U-46619 , or collagen.
[Uses]

ML 161 is a diaminobenzene derivative that acts as a selective inhibitor of platelet activation at protease-activated receptor 1 (PAR1). ML 161 has also been shown to inhibit thrombin-induced platelet activation.
[Definition]

ChEBI: 2-bromo-N-[3-(1-oxobutylamino)phenyl]benzamide is a member of benzamides.
[References]

[1]. dockendorff, c., et al., discovery of 1,3-diaminobenzenes as selective inhibitors of platelet activation at the par1 receptor. acs med chem lett, 2012. 3(3): p. 232-237.
[2]. verplank, l., et al., chemical genetic analysis of platelet granule secretion-probe 3, in probe reports from the nih molecular libraries program. 2010, national center for biotechnology information (us): bethesda (md).
Spectrum DetailBack Directory
[Spectrum Detail]

ML 161(423735-93-7)1HNMR
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