Commonly used Chinese name: decloxazole
Common English name: Bromazolam
CAS number: 71368-80-4
Molecular formula: C17H13BrN4
Molecular weight: 353.21600
Accurate mass: 352.03200
PSA: 43.07000
LogP: 3.12480
Melting point: 272.0-275℃
Boiling point: 519.8±60.0°C(Predicted)
Density: 1.54±0.1g/cm3(20ºC760Torr)
Solubility: DMF: 30mg/mL; DMF:PBS(pH7.2)(1:1) : 0.5mg/ml; DMSO: 20mg/mL; Ethanol: 10mg/mL; Methanol: 1mg/mL
Shape: Acidity coefficient of crystalline solid: (pKa)2.37±0.40(Predicted)
InChI: InChChemicalbookI = 1 s/C17H13BrN4 / c1-11-20-21-11-20-21-17 (12-5-3-12-5-3-12), 14-9-13 (18) 14-9-13 (14) and 22 (11) 16 / h2-9 h, h2, h3
InChIKey: KCEIOBKDDQAYCM-UHFFFAOYSA-N
SMILES: N12C(C)=NN=C1CN=C(C1=CC=CC=C1)C1=CC(Br)=CC=C12
Decloethazole has shown short-acting psychoactive effects and is marketed as a designer drug that is only half as potent as its parent compound, etizolam.
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