Merck
CN

I17451

Sigma-Aldrich

异烟酰胺

ReagentPlus®, 99%

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别名:
吡啶-4-甲酰胺
经验公式(希尔记法):
C6H6N2O
CAS号:
分子量:
122.12
Beilstein:
2173
EC 号:
MDL编号:
PubChem化学物质编号:
NACRES:
NA.22

产品线

ReagentPlus®

检测方案

99%

mp

155-157 °C (lit.)

SMILES string

NC(=O)c1ccncc1

InChI

1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9)

InChI key

VFQXVTODMYMSMJ-UHFFFAOYSA-N

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应用

异烟酰胺(吡啶-4-甲酰胺)可作为合成以下物质的杂环结构单元:
  • 潜在抗结核剂4-氧代-1,3-噻嗪烷-3-基异烟酰胺衍生物。
  • 通过合成氨基磷酸酯配体制备的用于各种生物活性研究的异烟酰胺有机锡 (IV) 复合物。
  • 2-(羟基亚氨基)-N-(吡啶-3-基)乙酰胺的双吡啶鎓异烟酰胺衍生物,其是一种强效活化剂沙林

它还可用作共晶试剂(co-former),与活性药物成分(API)一起制备共晶体。

法律信息

ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany

储存分类代码

11 - Combustible Solids

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

dust mask type N95 (US), Eyeshields, Gloves


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QSAR, docking studies of 1, 3-thiazinan-3-yl isonicotinamide derivatives for antitubercular activity
Chitre TS, et al.
Computational Biology and Chemistry, 68, 211-218 (2017)
New organotin (IV) complexes of nicotinamide, isonicotinamide and some of their novel phosphoric triamide derivatives: Syntheses, spectroscopic study and crystal structures
Gholivand K, et al.
Journal of Organometallic Chemistry, 695(9), 1383-1391 (2010)
Gareth Arnott et al.
Organic letters, 10(14), 3089-3092 (2008-06-17)
Treatment of N-arylisonicotinamides with trifluoromethanesulfonic anhydride triggers intramolecular nucleophilic attack of the aryl ring on the 4-position of the pyridinium intermediate. The products are spirocyclic dihydropyridines which can be converted to valuable spirocyclic piperidines related to biologically active molecules such
Rodrigo A de Souza et al.
European journal of medicinal chemistry, 45(11), 4863-4868 (2010-08-21)
Complexes of the type trans-[PdX(2)(isn)(2)] {X = Cl (1), N(3) (2), SCN (3), NCO (4); isn = isonicotinamide} were synthesized and evaluated for in vitro antimycobacterial and antitumor activities. The coordination mode of the isonicotinamide and the pseudohalide ligands was
Shaun R Stauffer et al.
Bioorganic & medicinal chemistry letters, 17(6), 1788-1792 (2007-01-30)
A series of low-molecular weight 2,6-diamino-isonicotinamide BACE-1 inhibitors containing an amine transition-state isostere were synthesized and shown to be highly potent in both enzymatic and cell-based assays. These inhibitors contain a trans-S,S-methyl cyclopropane P(3) which bind BACE-1 in a 10s-loop

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