4-氯-6-吗啉嘧啶-2-胺结构式
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常用名 | 4-氯-6-吗啉嘧啶-2-胺 | 英文名 | 4-Chloro-6-morpholinopyrimidin-2-amine |
|---|---|---|---|---|
| CAS号 | 339016-18-1 | 分子量 | 214.65200 | |
| 密度 | 1.399g/cm3 | 沸点 | 473.5ºC at 760mmHg | |
| 分子式 | C8H11ClN4O | 熔点 | 212-214℃ | |
| MSDS | N/A | 闪点 | 240.2ºC |
| 中文名 | 4-氯-6-吗啉-4-基嘧啶-2-胺 |
|---|---|
| 英文名 | 4-chloro-6-morpholin-4-ylpyrimidin-2-amine |
| 中文别名 | 2-氨基-4-氯-6-(4-吗啉基)嘧啶 |
| 英文别名 | 更多 |
| 密度 | 1.399g/cm3 |
|---|---|
| 沸点 | 473.5ºC at 760mmHg |
| 熔点 | 212-214℃ |
| 分子式 | C8H11ClN4O |
| 分子量 | 214.65200 |
| 闪点 | 240.2ºC |
| 精确质量 | 214.06200 |
| PSA | 64.27000 |
| LogP | 1.19500 |
| InChIKey | CWKCJXZYXLANTB-UHFFFAOYSA-N |
| SMILES | Nc1nc(Cl)cc(N2CCOCC2)n1 |
| 折射率 | 1.612 |
| 储存条件 | 保存方法:密闭,阴凉,通风干燥处 |
| 稳定性 | 避氧化物 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):0.9 2.氢键供体数量:1 3.氢键受体数量:5 4.可旋转化学键数量:1 5.互变异构体数量:3 6.拓扑分子极性表面积64.3 7.重原子数量:14 8.表面电荷:0 9.复杂度:188 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 |
| 更多 | 1. 性状:白色粉末 2. 密度(g/mL20ºC):未确定 3. 相对蒸汽密度(g/mL,空气=1):未确定 4. 熔点(ºC):未确定 5. 沸点(ºC,常压):未确定 6. 沸点(ºC4mmHg):未确定 7. 折射率:未确定 8. 闪点(º C4mmHg):未确定 9. 比旋光度(º):未确定 10. 自燃点或引燃温度(ºC):未确定 11. 蒸气压(kPa,):未确定 12. 饱和蒸气压(kPa,60ºC):未确定 13. 燃烧热(KJ/mol):未确定 14. 临界温度(ºC):未确定 15. 临界压力(KPa):未确定 16. 油水(辛醇/水)分配系数的对数值:未确定 17. 爆炸上限(%,V/V):未确定 18. 爆炸下限(%,V/V):未确定 19. 溶解性:未确定 |
| 海关编码 | 2934999090 |
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4-氯-6-吗啉嘧啶-2-胺 339016-18-1 |
| 文献:Journal of the American Chemical Society, , vol. 73, p. 3011 |
| 4-氯-6-吗啉嘧啶-2-胺上游产品 2 | |
|---|---|
| 4-氯-6-吗啉嘧啶-2-胺下游产品 0 | |
| 海关编码 | 2934999090 |
|---|---|
| 中文概述 | 2934999090. 其他杂环化合物. 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 |
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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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
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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
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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
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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
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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
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实验名称:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
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实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id:SIAE_INH_FP_1536_1X%INH PRUN
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| 4-chloro-6-morpholin-4-ylpyrimidine-2-ylamine |
| MFCD00664697 |
| 4-chloro-6-morpholinopyrimidin-2-amine |
| 4-Chlor-6-morpholino-pyrimidin-2-ylamin |
| 4-chloro-6-(morpholin-4-yl)pyrimidin-2-amine |
| 4-chloro-6-morpholino-pyrimidin-2-ylamine |
| 2-amino-4-chloro-6-morpholinopyrimidine |
| F3267-0044 |
| 4-chloro-6-morpholin-4-yl-pyrimidin-2-ylamine |
| 4-chloro-6-(4-morpholinyl)-2-pyrimidinamine |
| 2-AMINO-4-CHLORO-6-(4-MORPHOLINO)PYRIMIDINE |