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方案
99%
mp
122-124 °C (lit.)
SMILES字符串
Nc1nccc2ccccc12
InChI
1S/C9H8N2/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6H,(H2,10,11)
InChI key
OSILBMSORKFRTB-UHFFFAOYSA-N
应用
1-Aminoisoquinoline was used in the synthesis of pyrimidoisoquinolinone.
警示用语：
Warning
危险声明
危险分类
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
靶器官
Respiratory system
储存分类代码
11 - Combustible Solids
WGK
WGK 3
个人防护装备
dust mask type N95 (US), Eyeshields, Gloves
法规信息
新产品
Scott P Brown et al.
Journal of medicinal chemistry, 52(10), 3159-3165 (2009-04-24)
We apply a high-throughput formulation of the molecular mechanics with Poisson-Boltzmann surface area (htMM-PBSA) to estimate relative binding potencies on a set of 308 small-molecule ligands in complex with the proteins urokinase, PTP-1B, and Chk-1. We observe statistically significant correlation
Danqing Zheng et al.
Organic & biomolecular chemistry, 9(13), 4763-4765 (2011-05-28)
2-Alkynylbenzaldoxime reacts with amine catalyzed by silver triflate under mild conditions, leading to 1-aminoisoquinolines in good yield. This reaction proceeds efficiently with good functional group tolerance.
Adrian L Smith et al.
Journal of medicinal chemistry, 52(20), 6189-6192 (2009-09-22)
The discovery and optimization of a novel series of aminoisoquinolines as potent, selective, and efficacious inhibitors of the mutant B-Raf pathway is presented. The N-linked pyridylpyrimidine benzamide 2 was identified as a potent, modestly selective inhibitor of the B-Raf enzyme.
Hervé Bibas et al.
The Journal of organic chemistry, 67(8), 2619-2631 (2002-04-13)
The synthesis, spectroscopic properties, and chemical reactions of the stable (neopentylimino)-, (mesitylimino)-, and (o-tert-butylphenylimino)propadienones (6) are reported. Nucleophilic addition of amines affords the malonic amidoamidines 7 and 8. 3,5-Dimethylpyrazole reacts analogously to form 9b. Addition of 1,2-dimethylhydrazine produces pyrazolinones 10-12.
Xiaohong Wei et al.
Organic letters, 13(17), 4636-4639 (2011-08-05)
[RhCp*Cl(2)](2) can catalyze the oxidative coupling of N-aryl and N-alkyl benzamidines with alkynes to give N-substituted 1-aminoisoquinolines in high selectivity.
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