4-methoxy-N-(4-methylphenyl)benzenecarbothioamide结构式
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常用名 | 4-methoxy-N-(4-methylphenyl)benzenecarbothioamide | 英文名 | 4-methoxy-N-(4-methylphenyl)benzenecarbothioamide |
|---|---|---|---|---|
| CAS号 | 97317-28-7 | 分子量 | 257.35100 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C15H15NOS | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
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 | 4-methoxy-N-(4-methylphenyl)benzenecarbothioamide |
|---|---|
| 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。
| 分子式 | C15H15NOS |
|---|---|
| 分子量 | 257.35100 |
| 精确质量 | 257.08700 |
| PSA | 60.39000 |
| LogP | 4.01170 |
| InChIKey | IWVCEMRFDGIEMT-UHFFFAOYSA-N |
| SMILES | COc1ccc(C(=S)Nc2ccc(C)cc2)cc1 |
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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~83%
4-methoxy-N-(4-... 97317-28-7 |
| 文献:Waisser, Karel; Houngbedji, Nestor; Machacek, Milos; Sekera, Miroslav; Urban, Josef; Odlerova, Zelmira Collection of Czechoslovak Chemical Communications, 1990 , vol. 55, # 1 p. 307 - 316 |
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~%
4-methoxy-N-(4-... 97317-28-7 |
| 文献:Tust; Gattermann Chemische Berichte, 1892 , vol. 25, p. 3528 Journal fuer Praktische Chemie (Leipzig), 1899 , vol. <2>59, p. 577 |
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~%
4-methoxy-N-(4-... 97317-28-7 |
| 文献:Friedmann; Gattermann Chemische Berichte, 1892 , vol. 25, p. 3527 Full Text Show Details Tust; Gattermann Chemische Berichte, 1892 , vol. 25, p. 3528 Journal fuer Praktische Chemie (Leipzig), 1899 , vol. <2>59, p. 577 Full Text Show Details Gattermann Journal fuer Praktische Chemie (Leipzig), 1899 , vol. <2>59, # 576 p. 586 |
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 | |
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| 下游产品 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: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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实验名称:Absorbance-based primary biochemical high throughput screening assay to identify acti...
来源:The Scripps Research Institute Molecular Screening Center
靶标:caspase-3 preproprotein [Homo sapiens]
External Id:PROCASPASE3_ACT_EPIABS_1536_1X%ACT 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。
| 4-methoxy-4'-methylthiobenzanilide |
| Benzenecarbothioamide,4-methoxy-N-(4-methylphenyl) |
| 4-methoxy-thiobenzoic acid p-toluidide |
| N-o-Tolyl-thioanisamid |
| N-p-Tolyl-p-anissaeure-thioamid |
| Thioanissaeure-p-toluidid |
| 4-Methoxy-thiobenzoesaeure-p-toluidid |
| p-Aniso-p-toluidide,thio |
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: 97317-28-7的中文名称是什么? |
| A: 97317-28-7的中文名称为97317-28-7。 |
| Q: 97317-28-7的英文名称是什么? |
| A: 97317-28-7英文名称为4-methoxy-N-(4-methylphenyl)benzenecarbothioamide。 |
| Q: 97317-28-7的分子量是多少? |
| A: 97317-28-7分子量为257.35100。 |
| Q: 97317-28-7的InChIKey是什么? |
| A: 97317-28-7InChIKey为IWVCEMRFDGIEMT-UHFFFAOYSA-N。 |
| Q: 97317-28-7的LogP(油水分配系数)是多少? |
| A: 97317-28-7LogP(油水分配系数)为4.01170。 |
| Q: 97317-28-7的CAS号是多少? |
| A: 97317-28-7CAS号为97317-28-7。 |
| Q: 97317-28-7的分子式是什么? |
| A: 97317-28-7分子式为C15H15NOS。 |
| Q: 97317-28-7的上游原料有哪些? |
| A: 97317-28-7相关上游原料(CAS):39192-94-4;100-66-3;622-59-3;7446-70-0。 |
| Q: 97317-28-7的极性表面积PSA是多少? |
| A: 97317-28-7极性表面积PSA为60.39000。 |
| Q: 97317-28-7的SMILES表达式是什么? |
| A: 97317-28-7SMILES表达式为COc1ccc(C(=S)Nc2ccc(C)cc2)cc1。 |