(4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼结构式
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常用名 | (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼 | 英文名 | (4,5-DIHYDRO-THIAZOL-2-YL)-[2-(4-METHOXY-PHENYL)-ETHYL]-AMINE |
|---|---|---|---|---|
| CAS号 | 49656-91-9 | 分子量 | 325.38800 | |
| 密度 | 1.36g/cm3 | 沸点 | N/A | |
| 分子式 | C16H15N5OS | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
摘要:(4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼,英文名称为2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide,CAS号为49656-91-9,分子式为C16H15N5OS,分子量为325.38800,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。
| 中文名 | (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼 |
|---|---|
| 英文名 | 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide |
| 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 | 1.36g/cm3 |
|---|---|
| 分子式 | C16H15N5OS |
| 分子量 | 325.38800 |
| 精确质量 | 325.10000 |
| PSA | 111.13000 |
| LogP | 3.10750 |
| InChIKey | WDPSOMKCCCJRCE-UHFFFAOYSA-N |
| SMILES | NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1 |
| 折射率 | 1.702 |
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 | 2933990090 |
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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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~90%
(4,5-二苯基-4H-[1,... 49656-91-9 |
| 文献:Popiolek, Lukasz; Kosikowska, Urszula; Mazur, Liliana; Dobosz, Maria; Malm, Anna Medicinal Chemistry Research, 2013 , vol. 22, # 7 p. 3134 - 3147 |
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~%
(4,5-二苯基-4H-[1,... 49656-91-9 |
| 文献:Popiolek, Lukasz; Kosikowska, Urszula; Mazur, Liliana; Dobosz, Maria; Malm, Anna Medicinal Chemistry Research, 2013 , vol. 22, # 7 p. 3134 - 3147 |
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~%
(4,5-二苯基-4H-[1,... 49656-91-9 |
| 文献:Ismaiel, A. M.; Yousif, M. Y.; Metwally, M. A.; El-Kerdawy, M. M. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1984 , vol. 23, # 5 p. 489 - 491 |
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~%
(4,5-二苯基-4H-[1,... 49656-91-9 |
| 文献:Ismaiel, A. M.; Yousif, M. Y.; Metwally, M. A.; El-Kerdawy, M. M. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1984 , vol. 23, # 5 p. 489 - 491 |
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~%
(4,5-二苯基-4H-[1,... 49656-91-9 |
| 文献:Popiolek, Lukasz; Kosikowska, Urszula; Mazur, Liliana; Dobosz, Maria; Malm, Anna Medicinal Chemistry Research, 2013 , vol. 22, # 7 p. 3134 - 3147 |
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。
| 上游产品 4 | |
|---|---|
| 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 | 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% |
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: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: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:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标:N/A
External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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实验名称:Dicer-mediated maturation of pre-microRNA
来源:Center for Chemical Genomics, University of Michigan
靶标:N/A
External Id:TargetID_659_CEMA
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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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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-(4,5-diphenyl-4H-1,2,4-triazol-3-ylthio)acetohydrazide |
| [(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide |
| 2-(4,5-diphenyl-1,2,4-triazol-3-ylthio)acetohydrazide |
| 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide |
| (4,5-Diphenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid hydrazide |
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: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼的极性表面积PSA是多少? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼极性表面积PSA为111.13000。 |
| Q: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼的分子量是多少? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼分子量为325.38800。 |
| Q: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼的LogP(油水分配系数)是多少? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼LogP(油水分配系数)为3.10750。 |
| Q: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼的上游原料有哪些? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼相关上游原料(CAS):6596-82-3;103-72-0;613-94-5;1768-59-8。 |
| Q: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼的英文名称是什么? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼英文名称为2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide。 |
| Q: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼的CAS号是多少? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼CAS号为49656-91-9。 |
| Q: 49656-91-9的中文名称是什么? |
| A: 49656-91-9的中文名称为(4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼。 |
| Q: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼的SMILES表达式是什么? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼SMILES表达式为NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1。 |
| Q: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼有哪些英文别名? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼英文别名有:2-(4,5-diphenyl-4H-1,2,4-triazol-3-ylthio)acetohydrazide、 [(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide、 2-(4,5-diphenyl-1,2,4-triazol-3-ylthio)acetohydrazide、 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide、 (4,5-Diphenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid hydrazide。 |
| Q: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼的分子式是什么? |
| A: (4,5-二苯基-4H-[1,2,4]噻唑-3-磺酰基)-乙酸肼分子式为C16H15N5OS。 |
本表列出该化合物相关生产厂商、供应商信息,包含厂家名称、产品供应相关参考信息。
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