3-(2,5-dimethylphenyl)-4,5-dihydro-1H-pyridazin-6-one结构式
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常用名 | 3-(2,5-dimethylphenyl)-4,5-dihydro-1H-pyridazin-6-one | 英文名 | 3-(2,5-dimethylphenyl)-4,5-dihydro-1H-pyridazin-6-one |
|---|---|---|---|---|
| CAS号 | 4907-24-8 | 分子量 | 202.25200 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C12H14N2O | 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 | 3-(2,5-dimethylphenyl)-4,5-dihydro-1H-pyridazin-6-one |
|---|---|
| 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 | C12H14N2O |
|---|---|
| 分子量 | 202.25200 |
| 精确质量 | 202.11100 |
| PSA | 44.95000 |
| LogP | 1.62900 |
| InChIKey | ABLMMGBGXYSXLG-UHFFFAOYSA-N |
| SMILES | Cc1ccc(C)c(C2=NNC(=O)CC2)c1 |
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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~74%
3-(2,5-dimethyl... 4907-24-8 |
| 文献:Khan; Siddiqui Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2000 , vol. 39, # 8 p. 614 - 619 |
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~%
3-(2,5-dimethyl... 4907-24-8 |
| 文献:Khan; Siddiqui Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2000 , vol. 39, # 8 p. 614 - 619 |
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~%
3-(2,5-dimethyl... 4907-24-8 |
| 文献:Khan; Siddiqui Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2000 , vol. 39, # 8 p. 614 - 619 |
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 2 | |
|---|---|
| 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: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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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。
| HMS2796E10 |
| 6-<2,5-Dimethyl-phenyl>-2,3,4,5-tetrahydro-pyridazin-3-on |
| 3-Oxo-6-<2,5-dimethyl-phenyl>-2,3,4,5-tetrahydro-pyridazin |
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: 4907-24-8的分子量是多少? |
| A: 4907-24-8分子量为202.25200。 |
| Q: 4907-24-8的LogP(油水分配系数)是多少? |
| A: 4907-24-8LogP(油水分配系数)为1.62900。 |
| Q: 4907-24-8有哪些英文别名? |
| A: 4907-24-8英文别名有:HMS2796E10、 6--2,3,4,5-tetrahydro-pyridazin-3-on、 3-Oxo-6--2,3,4,5-tetrahydro-pyridazin。 |
| Q: 4907-24-8的极性表面积PSA是多少? |
| A: 4907-24-8极性表面积PSA为44.95000。 |
| Q: 4907-24-8的InChIKey是什么? |
| A: 4907-24-8InChIKey为ABLMMGBGXYSXLG-UHFFFAOYSA-N。 |
| Q: 4907-24-8的上游原料有哪些? |
| A: 4907-24-8相关上游原料(CAS):106-42-3;5394-59-2。 |
| Q: 4907-24-8的CAS号是多少? |
| A: 4907-24-8CAS号为4907-24-8。 |
| Q: 4907-24-8的中文名称是什么? |
| A: 4907-24-8的中文名称为4907-24-8。 |
| Q: 4907-24-8的分子式是什么? |
| A: 4907-24-8分子式为C12H14N2O。 |
| Q: 4907-24-8的SMILES表达式是什么? |
| A: 4907-24-8SMILES表达式为Cc1ccc(C)c(C2=NNC(=O)CC2)c1。 |