(4-chlorophenyl)-morpholin-4-ylmethanethione结构式
|
常用名 | (4-chlorophenyl)-morpholin-4-ylmethanethione | 英文名 | (4-chlorophenyl)-morpholin-4-ylmethanethione |
|---|---|---|---|---|
| CAS号 | 21011-44-9 | 分子量 | 241.73700 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C11H12ClNOS | 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-chlorophenyl)-morpholin-4-ylmethanethione |
|---|---|
| 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 | C11H12ClNOS |
|---|---|
| 分子量 | 241.73700 |
| 精确质量 | 241.03300 |
| PSA | 44.56000 |
| LogP | 2.28560 |
| InChIKey | QQAQCKDPIMFFLI-UHFFFAOYSA-N |
| SMILES | S=C(c1ccc(Cl)cc1)N1CCOCC1 |
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。
|
~78%
(4-chlorophenyl... 21011-44-9 |
| 文献:Aghapoor, Kioumars; Mohsenzadeh, Farshid; Khanalizadeh, Golriz; Darabi, Hossein R. Monatshefte fur Chemie, 2007 , vol. 138, # 1 p. 61 - 65 |
|
~87%
(4-chlorophenyl... 21011-44-9 |
| 文献:Otten, P. A.; Gen, A. van der Recueil des Travaux Chimiques des Pays-Bas, 1994 , vol. 113, # 11 p. 499 - 506 |
|
~77%
(4-chlorophenyl... 21011-44-9 |
| 文献:Aghapoor, Kioumars; Mohsenzadeh, Farshid; Khanalizadeh, Golriz; Darabi, Hossein R. Monatshefte fur Chemie, 2007 , vol. 138, # 1 p. 61 - 65 |
|
~58%
(4-chlorophenyl... 21011-44-9
查看详情
|
| 文献:Moghaddam, Firouz Matloubi; Hojabri, Leila; Dohendou, Mohammad Synthetic Communications, 2003 , vol. 33, # 24 p. 4279 - 4284 |
|
~%
(4-chlorophenyl... 21011-44-9 |
| 文献:Baudin, Jean-Bernard; Commenil, Marie-Gabrielle; Julia, Sylvestre A.; Lome, Robert; Ruel, Odile Bulletin de la Societe Chimique de France, 1996 , vol. 133, # 11 p. 1127 - 1141 |
|
~%
(4-chlorophenyl... 21011-44-9 |
| 文献:Otten, P. A.; Gen, A. van der Recueil des Travaux Chimiques des Pays-Bas, 1994 , vol. 113, # 11 p. 499 - 506 |
|
~30%
(4-chlorophenyl... 21011-44-9 |
| 文献:Moghaddam, Firouz Matloubi; Hojabri, Leila; Dohendou, Mohammad Synthetic Communications, 2003 , vol. 33, # 24 p. 4279 - 4284 |
|
~60%
(4-chlorophenyl... 21011-44-9 |
| 文献:Bhattacharya, Pranab K.; Bandyopadhyay, Soumitra; Pakrashi, Satyesch Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1989 , vol. 28, # 1-11 p. 673 - 674 |
|
~70%
(4-chlorophenyl... 21011-44-9 |
| 文献:Darabi, Hossein Reza; Aghapoor, Kioumars; Tajbakhsh, Mahmoud Tetrahedron Letters, 2004 , vol. 45, # 21 p. 4167 - 4169 |
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 8 | |
|---|---|
| 下游产品 6 | |
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。
|
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
|
|
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
|
|
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
|
|
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
|
|
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
|
|
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.
|
|
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
|
|
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
|
|
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
|
|
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
|
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-Chlorthiobenzmorpholid |
| 4-Chlorophenylthiomorpholide |
| HMS547M18 |
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: 21011-44-9的上游原料有哪些? |
| A: 21011-44-9相关上游原料(CAS):110-91-8;104-88-1;2362-79-0;140-53-4;20193-94-6;623-03-0;104-83-6;22699-29-2。 |
| Q: 21011-44-9的英文名称是什么? |
| A: 21011-44-9英文名称为(4-chlorophenyl)-morpholin-4-ylmethanethione。 |
| Q: 21011-44-9的分子量是多少? |
| A: 21011-44-9分子量为241.73700。 |
| Q: 21011-44-9的LogP(油水分配系数)是多少? |
| A: 21011-44-9LogP(油水分配系数)为2.28560。 |
| Q: 21011-44-9有哪些英文别名? |
| A: 21011-44-9英文别名有:4-Chlorthiobenzmorpholid、 4-Chlorophenylthiomorpholide、 HMS547M18。 |
| Q: 21011-44-9的SMILES表达式是什么? |
| A: 21011-44-9SMILES表达式为S=C(c1ccc(Cl)cc1)N1CCOCC1。 |
| Q: 21011-44-9的中文名称是什么? |
| A: 21011-44-9的中文名称为21011-44-9。 |
| Q: 21011-44-9的极性表面积PSA是多少? |
| A: 21011-44-9极性表面积PSA为44.56000。 |
| Q: 21011-44-9的InChIKey是什么? |
| A: 21011-44-9InChIKey为QQAQCKDPIMFFLI-UHFFFAOYSA-N。 |
| Q: 21011-44-9的CAS号是多少? |
| A: 21011-44-9CAS号为21011-44-9。 |