(1-Methyl-5-nitro-3-phenyl-1H-indol-2-yl)methanol , 95+% , 89159-60-4

Synonym(s):
1-Methyl-5-nitro-3-phenyl-1H-indole-2-methanol;VU0099704

CAS NO.：89159-60-4

Empirical Formula: C16H14N2O3

Molecular Weight: 282.29

MDL number: MFCD00593702

PRODUCT Properties

• Melting point: 178-179 °C(Solv: 1,4-dioxane (123-91-1))
• Boiling point: 544.0±50.0 °C(Predicted)
• Density: 1.29±0.1 g/cm3(Predicted)
• storage temp.: -20°C
• solubility: ≤2mg/ml in ethanol;20mg/ml in DMSO;20mg/ml in dimethyl formamide
• form: powder
• pka: 14.47±0.10(Predicted)
• color: white to beige
• Water Solubility: H2O: 10mg/mL, clear; DMSO: 25mg/mL, clear
• InChI: 1S/C16H14N2O3/c1-17-14-8-7-12(18(20)21)9-13(14)16(15(17)10-19)11-5-3-2-4-6-11/h2-9,19H,10H2,1H3
• InChIKey: GNJUKVGDCUKDLF-UHFFFAOYSA-N
• SMILES: CN(C(CO)=C1C2=CC=CC=C2)C3=C1C=C([N+]([O-])=O)C=C3

Description and Uses

ML-354 is an indole-based, proteinase-activated receptor 4 (PAR4) antagonist (IC₅₀ = 140 nM) that exhibits 71-fold selectivity for PAR4 over PAR1 (IC₅₀ = 10 μM) in isolated human platelets.

ML-354 is a selective protease activated receptor 4 ( PAR-4) antagonist used for its antithrombotic effects.

Safety

• Symbol(GHS): GHS06
• Signal word: Danger
• Hazard statements: H301
• Precautionary statements: P301+P310
• RIDADR: UN 2811 6.1 / PGIII
• WGK Germany: WGK 3
• Storage Class: 6.1C - Combustible acute toxic Cat.3; toxic compounds or compounds which causing chronic effects
• Hazard Classifications: Acute Tox. 3 Oral