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  • 4-碘-3-硝基-苯甲酰胺

    4-Iodo-3-nitrobenzamide

化合物简介

Iniparib (previously BSI 201) (4-iodo-3-nitrobenzamide) was a drug candidate for cancer treatment. It was originally believed to act as an irreversible inhibitor of PARP1 (hence, a PARP inhibitor) and possibly other enzymes through covalent modification, but its effects against PARP were later disproven. It underwent clinical trials for treatment of some types of breast cancer, but was discontinued after disappointing Phase III clinical trials.

基本信息

CAS:160003-66-7
中文别名:3-硝基-4-碘苯甲酰胺;
英文别名:Iniparib (BSI-201);4-iodo-3-nitrobenzamide;
分子式:C7H5IN2O3
分子量:292.031
精确质量:291.934
Psa:88.91
Logp:2.5218

编号系统

MDL号:MFCD11110639

物化性质

密度:2.056g/cm3
沸点:344.754ºC at 760 mmHg
闪点:162.302ºC
折射率:1.696
蒸汽压:0mmHg at 25°C

安全信息

海关编码:2924299090
危险性防范说明:P305 + P351 + P338
信号词:Warning
危险性描述:H302; H319
危险标志:GHS07

生产方法及用途

合成路线

上游原料

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图谱

13C NMR : Predict


1H NMR : Predict


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