4-(4-氯苯基)-4-噻唑啉-2-硫酮结构式
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常用名 | 4-(4-氯苯基)-4-噻唑啉-2-硫酮 | 英文名 | 4-(4-CHLOROPHENYL)-4-THIAZOLINE-2-THIONE |
|---|---|---|---|---|
| CAS号 | 2104-00-9 | 分子量 | 227.73400 | |
| 密度 | 1.49 | 沸点 | 359.3ºC at 760 mmHg | |
| 分子式 | C9H6ClNS2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 171.1ºC |
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-(4-氯苯基)-4-噻唑啉-2-硫酮 |
|---|---|
| 英文名 | 4-(4-chlorophenyl)-3H-1,3-thiazole-2-thione |
| 中文别名 | 4-(4-氯苯基)-2(3h)-噻唑硫酮 |
| 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 | 1.49 |
|---|---|
| 沸点 | 359.3ºC at 760 mmHg |
| 分子式 | C9H6ClNS2 |
| 分子量 | 227.73400 |
| 闪点 | 171.1ºC |
| 精确质量 | 226.96300 |
| PSA | 79.93000 |
| LogP | 3.75220 |
| InChIKey | LXFBSCKJEIVRGP-UHFFFAOYSA-N |
| SMILES | S=c1[nH]c(-c2ccc(Cl)cc2)cs1 |
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 | 2934100090 |
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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。
| 4-(4-氯苯基)-4-噻唑啉-2-硫酮上游产品 6 | |
|---|---|
| 4-(4-氯苯基)-4-噻唑啉-2-硫酮下游产品 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 | 2934100090 |
|---|---|
| 中文概述 | 2934100090. 结构上含有一个非稠合噻唑环的化合物(不论是否氢化). 增值税率:17.0%. 退税率:9.0%. 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 | 2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none 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: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: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: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。
| 4-(p-Chlorophenyl)-2-mercaptothiazole |
| 4-(4-chloro-phenyl)-3H-thiazole-2-thione |
| 4-(4-chlorophenyl)-2-mercaptothiazole |
| 4-(4-chlorophenyl)thiazole-2-thiol |
| 4-(4-Chlorophenyl)-4-thiazoline-2-thione |
| HMS2722P12 |
| 4-(4-chlorophenyl)-1,3-thiazole-2-thiol |
| 4-<4-Chlor-phenyl>-2-mercapto-thiazol |
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-(4-氯苯基)-4-噻唑啉-2-硫酮的LogP(油水分配系数)是多少? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮LogP(油水分配系数)为3.75220。 |
| Q: 4-(4-氯苯基)-4-噻唑啉-2-硫酮的InChIKey是什么? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮InChIKey为LXFBSCKJEIVRGP-UHFFFAOYSA-N。 |
| Q: 4-(4-氯苯基)-4-噻唑啉-2-硫酮的沸点是多少? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮沸点为359.3ºC at 760 mmHg。 |
| Q: 4-(4-氯苯基)-4-噻唑啉-2-硫酮的极性表面积PSA是多少? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮极性表面积PSA为79.93000。 |
| Q: 4-(4-氯苯基)-4-噻唑啉-2-硫酮有哪些中文别名? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮中文别名有:4-(4-氯苯基)-2(3h)-噻唑硫酮。 |
| Q: 4-(4-氯苯基)-4-噻唑啉-2-硫酮的分子量是多少? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮分子量为227.73400。 |
| Q: 4-(4-氯苯基)-4-噻唑啉-2-硫酮的分子式是什么? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮分子式为C9H6ClNS2。 |
| Q: 4-(4-氯苯基)-4-噻唑啉-2-硫酮的上游原料有哪些? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮相关上游原料(CAS):513-74-6;536-38-9;19339-59-4;99-91-2;25917-49-1;333-20-0。 |
| Q: 2104-00-9的中文名称是什么? |
| A: 2104-00-9的中文名称为4-(4-氯苯基)-4-噻唑啉-2-硫酮。 |
| Q: 4-(4-氯苯基)-4-噻唑啉-2-硫酮的SMILES表达式是什么? |
| A: 4-(4-氯苯基)-4-噻唑啉-2-硫酮SMILES表达式为S=c1[nH]c(-c2ccc(Cl)cc2)cs1。 |
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。
| 上海阿拉丁生化科技股份有限公司 |
| 上海化源世纪贸易有限公司 |