2,4-DIAMINO-6-METHYL-5-PHENYLPYRIMIDINE结构式
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常用名 | 2,4-DIAMINO-6-METHYL-5-PHENYLPYRIMIDINE | 英文名 | 2,4-DIAMINO-6-METHYL-5-PHENYLPYRIMIDINE |
|---|---|---|---|---|
| CAS号 | 18588-50-6 | 分子量 | 200.24000 | |
| 密度 | 1.236g/cm3 | 沸点 | 431.9ºC at 760 mmHg | |
| 分子式 | C11H12N4 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 244.9ºC |
摘要:6-甲基-5-苯基嘧啶-2,4-二胺(英文名:2,4-二氨基-6-甲基-5-苯基嘧啶,CAS号:18588-50-6,分子式:C11H12N4,分子量:200.24000),仅供科研实验参考,不作为医疗诊断与用药依据。
本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。
| 英文名 | 6-methyl-5-phenylpyrimidine-2,4-diamine |
|---|---|
| 英文别名 | 更多 |
本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。
| 密度 | 1.236g/cm3 |
|---|---|
| 沸点 | 431.9ºC at 760 mmHg |
| 分子式 | C11H12N4 |
| 分子量 | 200.24000 |
| 闪点 | 244.9ºC |
| 精确质量 | 200.10600 |
| PSA | 77.82000 |
| LogP | 2.77880 |
| InChIKey | RBOOBZAJMOATAV-UHFFFAOYSA-N |
| SMILES | Cc1nc(N)nc(N)c1-c1ccccc1 |
| 蒸汽压 | 1.16E-07mmHg at 25°C |
| 折射率 | 1.667 |
本表汇总该化学品毒理试验数据、急性慢性毒性以及环境生态危害相关参数。
本表记录该化合物安全警示、防护措施、禁配物、处置方式等安全相关参考信息。
| 海关编码 | 2933599090 |
|---|
本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。
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~%
2,4-DIAMINO-6-M... 18588-50-6 |
| 文献:Tarnchompoo, Bongkoch; Sirichaiwat, Chawanee; Phupong, Worrapong; Intaraudom, Chakapong; Sirawaraporn, Worachart; Kamchonwongpaisan, Sumalee; Vanichtanankul, Jarunee; Thebtaranonth, Yodhathai; Yuthavong, Yongyuth Journal of Medicinal Chemistry, 2002 , vol. 45, # 6 p. 1244 - 1252 |
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2,4-DIAMINO-6-M... 18588-50-6 |
| 文献:Russell; Hitchings Journal of the American Chemical Society, 1951 , vol. 73, p. 3763,3766 |
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~%
2,4-DIAMINO-6-M... 18588-50-6 |
| 文献:Tarnchompoo, Bongkoch; Sirichaiwat, Chawanee; Phupong, Worrapong; Intaraudom, Chakapong; Sirawaraporn, Worachart; Kamchonwongpaisan, Sumalee; Vanichtanankul, Jarunee; Thebtaranonth, Yodhathai; Yuthavong, Yongyuth Journal of Medicinal Chemistry, 2002 , vol. 45, # 6 p. 1244 - 1252 |
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~%
2,4-DIAMINO-6-M... 18588-50-6 |
| 文献:Chase; Walker Journal of the Chemical Society, 1953 , p. 3518,3523 |
本表列出该化学品对应的上游起始原料以及下游衍生产物清单。
| 2,4-DIAMINO-6-METHYL-5-PHENYLPYRIMIDINE上游产品 5 | |
|---|---|
| 2,4-DIAMINO-6-METHYL-5-PHENYLPYRIMIDINE下游产品 0 | |
本表展示该化学品海关编码、关税、监管条件等进出口海关参考数据。
| 海关编码 | 2933599090 |
|---|---|
| 中文概述 | 2933599090. 其他结构上有嘧啶环的化合物(包括其他结构上有哌嗪环的化合物. 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 | 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。
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实验名称:Ratio of Inhibition of the C59R+S108N mutant of dihydrofolate reductase (DHFR) to inh...
来源:ChEMBL
靶标:Bifunctional dihydrofolate reductase-thymidylate synthase
External Id:CHEMBL849932
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实验名称:Ratio of Inhibition of the S108N mutant of dihydrofolate reductase (DHFR) to inhibiti...
来源:ChEMBL
靶标:Bifunctional dihydrofolate reductase-thymidylate synthase
External Id:CHEMBL848232
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实验名称:Inhibition constant against Plasmodium falciparum dihydrofolate reductase
来源:ChEMBL
靶标:Bifunctional dihydrofolate reductase-thymidylate synthase
External Id:CHEMBL828776
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实验名称:Inhibition of the C59R+S108N mutant of dihydrofolate reductase (DHFR)
来源:ChEMBL
靶标:Bifunctional dihydrofolate reductase-thymidylate synthase
External Id:CHEMBL668409
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实验名称:Inhibition of the S108N mutant of dihydrofolate reductase (DHFR)
来源:ChEMBL
靶标:Bifunctional dihydrofolate reductase-thymidylate synthase
External Id:CHEMBL668410
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实验名称:Inhibition of the wild-type dihydrofolate reductase (DHFR)
来源:ChEMBL
靶标:Bifunctional dihydrofolate reductase-thymidylate synthase
External Id:CHEMBL668411
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实验名称:IC50 ratio against Plasmodium falciparum K1CB1/TM4
来源:ChEMBL
靶标:Plasmodium falciparum
External Id:CHEMBL849104
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实验名称:In vitro antiplasmodial activity (IC50) against Plasmodium falciparum wtTM4/8.2
来源:ChEMBL
靶标:Plasmodium falciparum
External Id:CHEMBL767132
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实验名称:Inhibition of yeast DHFR expressed in Saccharomyces cerevisiae TB5 assessed as yeast ...
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL905734
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实验名称:Inhibition of mutant C59R+S108N dihydrofolate reductase (DHFR) relative to Pyr
来源:ChEMBL
靶标:Bifunctional dihydrofolate reductase-thymidylate synthase
External Id:CHEMBL668417
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本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。
| 2,4-Diamino-6-methyl-5-phenylpyrimidine |
| 2,4-Diamino-5-phenyl-6-methylpyrimidine |
| Pyrimidine,2,4-diamino-6-methyl-5-phenyl |
| 2,4-Diamino-5-phenyl-6-methylpyrimidin |
| 6-Methyl-5-phenyl-2,4-pyrimidinediamine |
| 6-methyl-5-phenyl-pyrimidine-2,4-diyldiamine |
| 6-methyl-5-phenyl-pyrimidine-2,4-diamine |
| IEM-687 |
| 6-Methyl-5-phenyl-pyrimidin-2,4-diyldiamin |
本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。
| Q: 18588-50-6的InChIKey是什么? |
| A: 18588-50-6InChIKey为RBOOBZAJMOATAV-UHFFFAOYSA-N。 |
| Q: 18588-50-6的CAS号是多少? |
| A: 18588-50-6CAS号为18588-50-6。 |
| Q: 18588-50-6的LogP(油水分配系数)是多少? |
| A: 18588-50-6LogP(油水分配系数)为2.77880。 |
| Q: 18588-50-6有哪些英文别名? |
| A: 18588-50-6英文别名有:2,4-Diamino-6-methyl-5-phenylpyrimidine、 2,4-Diamino-5-phenyl-6-methylpyrimidine、 Pyrimidine,2,4-diamino-6-methyl-5-phenyl、 2,4-Diamino-5-phenyl-6-methylpyrimidin、 6-Methyl-5-phenyl-2,4-pyrimidinediamine、 6-methyl-5-phenyl-pyrimidine-2,4-diyldiamine、 6-methyl-5-phenyl-pyrimidine-2,4-diamine、 IEM-687、 6-Methyl-5-phenyl-pyrimidin-2,4-diyldiamin。 |
| Q: 18588-50-6的中文名称是什么? |
| A: 18588-50-6的中文名称为18588-50-6。 |
| Q: 18588-50-6的沸点是多少? |
| A: 18588-50-6沸点为431.9ºC at 760 mmHg。 |
| Q: 18588-50-6的分子量是多少? |
| A: 18588-50-6分子量为200.24000。 |
| Q: 18588-50-6的英文名称是什么? |
| A: 18588-50-6英文名称为6-methyl-5-phenylpyrimidine-2,4-diamine。 |
| Q: 18588-50-6的上游原料有哪些? |
| A: 18588-50-6相关上游原料(CAS):140-29-4;186581-53-3;4468-48-8;22211-32-1;113-00-8。 |
| Q: 18588-50-6的极性表面积PSA是多少? |
| A: 18588-50-6极性表面积PSA为77.82000。 |