N-acetyl-5-bromo-4,6-dimethyl-7-nitroindoline | 189200-24-6
中文名称
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中文别名
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英文名称
N-acetyl-5-bromo-4,6-dimethyl-7-nitroindoline
英文别名
1-acetyl-5-bromo-4,6-dimethyl-7-nitroindoline；1-(5-Bromo-4,6-dimethyl-7-nitroindolin-1-yl)ethanone；1-(5-bromo-4,6-dimethyl-7-nitro-2,3-dihydroindol-1-yl)ethanone
CAS
189200-24-6
化学式
C12H13BrN2O3
mdl
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分子量
313.151
InChiKey
MGXWWJJALMAULH-UHFFFAOYSA-N
BEILSTEIN
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EINECS
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物化性质
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计算性质
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ADMET
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安全信息
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SDS
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制备方法与用途
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上下游信息
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文献信息
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表征谱图
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同类化合物
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相关功能分类
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相关结构分类
物化性质
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沸点：535.2±50.0 °C(Predicted)
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密度：1.554±0.06 g/cm3(Predicted)
计算性质
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辛醇/水分配系数(LogP)：2.6
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重原子数：18
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可旋转键数：0
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环数：2.0
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sp3杂化的碳原子比例：0.42
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拓扑面积：66.1
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氢给体数：0
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氢受体数：3
上下游信息
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上游原料
中文名称 英文名称 CAS号 化学式 分子量 —— 1-acetyl-5-bromo-4,6-dimethylindoline 178469-86-8 C12H14BrNO 268.153 —— N-acetyl-4,6-dimethylindoline 131880-74-5 C12H15NO 189.257 -
下游产品
中文名称 英文名称 CAS号 化学式 分子量 —— 5-Bromo-1-ethyl-4,6-dimethyl-7-nitro-2,3-dihydro-1H-indole 1025835-43-1 C12H15BrN2O2 299.167 —— 5-Bromo-1-butyl-4,6-dimethyl-7-nitro-2,3-dihydro-1H-indole 1028256-00-9 C14H19BrN2O2 327.221 —— N-hexyl-5-bromo-4,6-dimethyl-7-nitroindoline 288459-39-2 C16H23BrN2O2 355.275 —— 5-bromo-4,6-dimethyl-7-nitroindoline 178469-87-9 C10H11BrN2O2 271.114 —— N-(1-acetyl-4,6-dimethylindolin-7-yl)-2,2-dimethylpropanamide 189199-89-1 C17H24N2O2 288.39 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)pentanamide —— C21H34N2O 330.514 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)-4-carboxy-3,3-dimethylbutanamide —— C23H36N2O3 388.55 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)-3-hydroxy-2,2-dimethylpropanamide —— C21H34N2O2 346.513 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)-3,3-dimethylbutanamide —— C22H36N2O 344.541 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)acetamide —— C18H28N2O 288.433 —— N-(1-ethyl-4,6-dimethylindolin-7-yl)-2,2-dimethylpropanamide —— C17H26N2O 274.406 —— N-(4,6-dimethyl-1-pentylindolin-7-yl)-2,2-dimethylpropanamide 178469-71-1 C20H32N2O 316.487 —— N-(1-butyl-4,6-dimethylindolin-7-yl)-2,2-dimethylpropanamide —— C19H30N2O 302.46 —— N-[1-(2-ethylbutyl)-4,6-dimethylindolin-7-yl]-2,2-dimethylpropanamide —— C21H34N2O 330.514 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)-2-methylpropanamide —— C20H32N2O 316.487 —— N-(1-hexyl-4,6-dimethylindolindolin-7-yl)-2,2-dimethylpropanamide —— C21H34N2O 330.514 —— N-[1-(5-carboxypentyl)-4,6-dimethylindolin-7-yl]-2,2-dimethylpropanamide —— C21H32N2O3 360.497 —— N-(1-cyclohexylmethyl-4,6-dimethylindolin-7-yl)-2,2-dimethylpropanamide —— C22H34N2O 342.525 —— N-(1-heptyl-4,6-dimethylindolin-7-yl)-2,2-dimethylpropanamide —— C22H36N2O 344.541 —— N-(1-decyl-4,6-dimethylindolin-7-yl)-2,2-dimethylpropanamide 288462-23-7 C25H42N2O 386.621 —— N-(1-dodecyl-4,6-dimethylindolin-7-yl)-2,2-dimethylpropanamide —— C27H46N2O 414.675 —— N-(4,6-dimethyl-1-octylindolin-7-yl)-2,2-dimethylpropanamide —— C23H38N2O 358.568 —— N-(1-isopentyl-4,6-dimethylindolin-7-yl)-2,2-dimethylpropanamide —— C20H32N2O 316.487 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)-1-ethylpiperidine-4-carboxamide —— C24H39N3O 385.593 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)-2,2-dimethylhexanamide —— C24H40N2O 372.594 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)cyclopropanecarboxamide —— C20H30N2O 314.471 —— N-{4,6-dimethyl-1-[8-(N,N-dimethylamino)octyl]indolin-7-yl}-2,2-dimethylpropanamide —— C25H43N3O 401.636 —— N-[4,6-dimethyl-1-(3-morpholinopropyl)indolin-7-yl]-2,2-dimethylpropanamide —— C22H35N3O2 373.539 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)-2,2-dimethyloctanamide —— C26H44N2O 400.648 —— N-[4,6-dimethyl-1-(3-methyl-2-butenyl)indolin-7-yl]-2,2-dimethylpropanamide —— C20H30N2O 314.471 —— N-(1-ethyl-4,6-dimethylindolin-7-yl)-2,2-dimethylundecanamide —— C25H42N2O 386.621 —— N-(1-ethyl-4,6-dimethylindolin-7-yl)-2,2-dimethyloctanamide —— C22H36N2O 344.541 —— N-[1-(8-1H-imidazolyloctyl)-4,6-dimethylindolin-7-yl]-2,2-dimethylpropanamide —— C26H40N4O 424.63 —— N-{4,6-dimethyl-1-[8-(N-methylpiperazinyl)octyl]indolin-7-yl}-2,2-dimethylpropanamide —— C28H48N4O 456.715 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)-N'-butylurea —— C21H35N3O 345.528 —— N-(1-hexyl-4,6-dimethylindolin-7-yl)nicotinamide —— C22H29N3O 351.492 —— 7-Amino-4,6-dimethyl-1-hexylindoline 178469-88-0 C16H26N2 246.396 - 1
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反应信息
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作为反应物：描述：N-acetyl-5-bromo-4,6-dimethyl-7-nitroindoline 在 palladium on activated charcoal 氢气 作用下， 以 甲醇 为溶剂， 30.0 ℃ 、303.97 kPa 条件下， 反应 10.0h， 生成 1-(7-Amino-4,6-dimethyl-2,3-dihydro-indol-1-yl)-ethanone参考文献：名称：可生物利用的酰基辅酶A：具有抗过氧化活性的胆固醇酰基转移酶抑制剂：新型吲哚基酰胺和脲衍生物的合成和生物活性。摘要：我们合成了一系列具有酰胺或脲部分的吲哚啉衍生物，并研究了它们对实验动物中酰基辅酶A：胆固醇酰基转移酶（