4(3H)-Pyrimidinone,2-[(phenylmethyl)thio]结构式
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常用名 | 4(3H)-Pyrimidinone,2-[(phenylmethyl)thio] | 英文名 | 4(3H)-Pyrimidinone,2-[(phenylmethyl)thio] |
|---|---|---|---|---|
| CAS号 | 31167-21-2 | 分子量 | 218.27500 | |
| 密度 | 1.25g/cm3 | 沸点 | 410.9ºC at 760mmHg | |
| 分子式 | C11H10N2OS | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 202.3ºC |
| 英文名 | 2-benzylsulfanyl-1H-pyrimidin-6-one |
|---|---|
| 英文别名 | 更多 |
| 密度 | 1.25g/cm3 |
|---|---|
| 沸点 | 410.9ºC at 760mmHg |
| 分子式 | C11H10N2OS |
| 分子量 | 218.27500 |
| 闪点 | 202.3ºC |
| 精确质量 | 218.05100 |
| PSA | 71.05000 |
| LogP | 2.06220 |
| InChIKey | XLYQVVDCFZRIJB-UHFFFAOYSA-N |
| SMILES | O=c1ccnc(SCc2ccccc2)[nH]1 |
| 折射率 | 1.643 |
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~26%
4(3H)-Pyrimidin... 31167-21-2 |
| 文献:Prachayasittikul, Supaluk; Worachartcheewan, Apilak; Nantasenamat, Chanin; Chinworrungsee, Maneekarn; Sornsongkhram, Nirun; Ruchirawat, Somsak; Prachayasittikul, Virapong European Journal of Medicinal Chemistry, 2011 , vol. 46, # 2 p. 738 - 742 |
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~88%
4(3H)-Pyrimidin... 31167-21-2 |
| 文献:Jeelan Basha; Upendar Reddy; Goudgaon Journal of the Indian Chemical Society, 2009 , vol. 86, # 7 p. 728 - 733 |
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~98%
4(3H)-Pyrimidin... 31167-21-2 |
| 文献:Font, David; Heras, Montserrat; Villalgordo, Jose M. Synthesis, 2002 , # 13 p. 1833 - 1842 |
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~81%
4(3H)-Pyrimidin... 31167-21-2 |
| 文献:Font, David; Heras, Montserrat; Villalgordo, Jose M. Synthesis, 2002 , # 13 p. 1833 - 1842 |
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~96%
4(3H)-Pyrimidin... 31167-21-2 |
| 文献:Font, David; Heras, Montserrat; Villalgordo, Jose M. Synthesis, 2002 , # 13 p. 1833 - 1842 |
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~%
4(3H)-Pyrimidin... 31167-21-2 |
| 文献:Johnson; Joyce Journal of the American Chemical Society, 1916 , vol. 38, p. 1390 |
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实验名称:Cytotoxicity against human MDA-MB-231 cells after 3 days by MTT assay
来源:ChEMBL
靶标:MDA-MB-231
External Id:CHEMBL1669843
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实验名称:qHTS screening for TAG (triacylglycerol) accumulators in algae
来源:11812
靶标:N/A
External Id:FATTTLab-Algae-Lipid
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实验名称:Cytotoxicity against human T47D cells after 3 days by MTT assay
来源:ChEMBL
靶标:T47D
External Id:CHEMBL1669844
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实验名称:Cytotoxicity against human A549 cells after 3 days by MTT assay
来源:ChEMBL
靶标:A549
External Id:CHEMBL1669845
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实验名称:Cytotoxicity against human H69AR cells after 3 days by MTT assay
来源:ChEMBL
靶标:H69AR
External Id:CHEMBL1669847
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实验名称:Cytotoxicity against human HeLa cells after 3 days by MTT assay
来源:ChEMBL
靶标:HeLa
External Id:CHEMBL1669848
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实验名称:Cytotoxicity against human HepG2 cells after 3 days by MTT assay
来源:ChEMBL
靶标:HepG2
External Id:CHEMBL1669849
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实验名称:Cytotoxicity against human HCC-S102 cells after 3 days by MTT assay
来源:ChEMBL
靶标:NON-PROTEIN TARGET
External Id:CHEMBL1669850
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实验名称:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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实验名称:Cytotoxicity against human KB cells after 3 days by MTT assay
来源:ChEMBL
靶标:KB
External Id:CHEMBL1669841
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| 2-Benzylmercapto-3H-pyrimidin-4-on |
| 2-benzylmercapto-3H-pyrimidin-4-one |
| 2-benzylsulfanyl-3H-pyrimidin-4-one |
| 2-benzylthiouracil |