6-(哌啶-1-基)-9H-嘌呤结构式
|
常用名 | 6-(哌啶-1-基)-9H-嘌呤 | 英文名 | 9H-Purine,6-(1-piperidinyl) |
|---|---|---|---|---|
| CAS号 | 1928-81-0 | 分子量 | 203.24400 | |
| 密度 | 1.47g/cm3 | 沸点 | 330.8ºC at 760mmHg | |
| 分子式 | C10H13N5 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 153.8ºC |
| 中文名 | 6-哌啶嘌呤 |
|---|---|
| 英文名 | 6-piperidin-1-yl-7H-purine |
| 英文别名 | 更多 |
| 密度 | 1.47g/cm3 |
|---|---|
| 沸点 | 330.8ºC at 760mmHg |
| 分子式 | C10H13N5 |
| 分子量 | 203.24400 |
| 闪点 | 153.8ºC |
| 精确质量 | 203.11700 |
| PSA | 57.70000 |
| LogP | 1.40820 |
| InChIKey | OXCZAXJFRBPQRP-UHFFFAOYSA-N |
| SMILES | c1nc(N2CCCCC2)c2[nH]cnc2n1 |
| 蒸汽压 | 1.27E-09mmHg at 25°C |
| 折射率 | 1.672 |
| 储存条件 | 2-8°C, 干燥 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):无 2.氢键供体数量:1 3.氢键受体数量:4 4.可旋转化学键数量:1 5.互变异构体数量:4 6.拓扑分子极性表面积57.7 7.重原子数量:15 8.表面电荷:0 9.复杂度:216 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:0 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1 |
| 海关编码 | 2933990090 |
|---|
|
~95%
6-(哌啶-1-基)-9H-嘌呤 1928-81-0 |
| 文献:Huang, Ling-Kuen; Cherng, Yen-Chih; Cheng, Yann-Ru; Jang, Jing-Pei; Chao, Yi-Ling; Cherng, Yie-Jia Tetrahedron, 2007 , vol. 63, # 24 p. 5323 - 5327 |
|
~54%
6-(哌啶-1-基)-9H-嘌呤 1928-81-0 |
| 文献:Girgis; Pedersen Synthesis, 1982 , vol. No. 6, p. 480 - 482 |
|
~45%
6-(哌啶-1-基)-9H-嘌呤 1928-81-0 |
| 文献:Alves, M. Jose; Carvalho, M. Alice; Carvalho, Silvia; Dias, Alice M.; Fernandes, Francisco H.; Proenca, M. Fernanda European Journal of Organic Chemistry, 2007 , # 29 p. 4881 - 4887 |
| 6-(哌啶-1-基)-9H-嘌呤上游产品 4 | |
|---|---|
| 6-(哌啶-1-基)-9H-嘌呤下游产品 1 | |
| 海关编码 | 2933990090 |
|---|---|
| 中文概述 | 2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0% |
| 申报要素 | 品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期 |
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
|
实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
|
|
实验名称:Antibacterial activity against Staphylococcus aureus ATCC 25923 after 24 hrs by two f...
来源:ChEMBL
靶标:Staphylococcus aureus
External Id:CHEMBL4222944
|
|
实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
|
|
实验名称:Antibacterial activity against Staphylococcus aureus after 24 hrs by two fold serial ...
来源:ChEMBL
靶标:Staphylococcus aureus
External Id:CHEMBL4222943
|
|
实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
|
|
实验名称:Antibacterial activity against Klebsiella pneumoniae after 24 hrs by two fold serial ...
来源:ChEMBL
靶标:Klebsiella pneumoniae
External Id:CHEMBL4222946
|
|
实验名称:Antibacterial activity against Staphylococcus aureus ATCC 29213 after 24 hrs by two f...
来源:ChEMBL
靶标:Staphylococcus aureus
External Id:CHEMBL4222945
|
|
实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
|
|
实验名称:Antibacterial activity against Enterococcus faecalis after 24 hrs by two fold serial ...
来源:ChEMBL
靶标:Enterococcus faecalis
External Id:CHEMBL4222942
|
|
实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
|
| 6-piperidylpurine |
| 6-(piperidin-1-yl) purine |
| 6-(piperidin-1-yl)-7H-purine |
| 6-(piperidin-1-yl)-9H-purine |
| 6-(1-Piperidinyl)-9H-purin |
| 6-piperidin-1-yl-7(9)H-purine |
| 6-PIPERIDINOPURINE |
| 6-piperidinyl-purine |