2-(4-fluorophenyl)-5-methyl-1-(4-methylsulfonylphenyl)pyrrole
更新时间：2025-10-04 11:39:59
2-(4-fluorophenyl)-5-methyl-1-(4-methylsulfonylphenyl)pyrrole结构式
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常用名 | 2-(4-fluorophenyl)-5-methyl-1-(4-methylsulfonylphenyl)pyrrole | 英文名 | 2-(4-fluorophenyl)-5-methyl-1-(4-methylsulfonylphenyl)pyrrole |
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| CAS号 | 189500-91-2 | 分子量 | 329.38900 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C18H16FNO2S | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 英文名 | 2-(4-fluorophenyl)-5-methyl-1-(4-methylsulfonylphenyl)pyrrole |
|---|
| 分子式 | C18H16FNO2S |
|---|---|
| 分子量 | 329.38900 |
| 精确质量 | 329.08900 |
| PSA | 47.45000 |
| LogP | 5.07610 |
| InChIKey | ZPBAXSZKIYTVQU-UHFFFAOYSA-N |
| SMILES | Cc1ccc(-c2ccc(F)cc2)n1-c1ccc(S(C)(=O)=O)cc1 |
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~86%
2-(4-fluorophen... 189500-91-2 |
| 文献：Biava, Mariangela; Porretta, Giulio Cesare; Poce, Giovanna; Supino, Sibilla; Forli, Stefano; Rovini, Michele; Cappelli, Andrea; Manetti, Fabrizio; Botta, Maurizio; Sautebin, Lidia; Rossi, Antonietta; Pergola, Carlo; Ghelardini, Carla; Vivoli, Elisa; Makovec, Francesco; Anzellotti, Paola; Patrignani, Paola; Anzini, Maurizio Journal of Medicinal Chemistry, 2007 , vol. 50, # 22 p. 5403 - 5411 |
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~%
2-(4-fluorophen... 189500-91-2 |
| 文献：Khanna, Ish K.; Weier, Richard M.; Yu, Yi; Collins, Paul W.; Miyashiro, Julie M.; Koboldt, Carol M.; Veenhuizen, Amy W.; Currie, Jerry L.; Seibert, Karen; Isakson, Peter C. Journal of Medicinal Chemistry, 1997 , vol. 40, # 11 p. 1619 - 1633 |
![1-[4-(fluoro)-phenyl]pentane-1,4-dione结构式](https://image.chemsrc.com/caspic/267/123183-95-9.png)
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实验名称：In vitro inhibitory activity against human prostaglandin G/H synthase 1
来源：ChEMBL
靶标：Prostaglandin G/H synthase 1
External Id：CHEMBL768745
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实验名称：In vitro inhibitory activity against human prostaglandin G/H synthase 2
来源：ChEMBL
靶标：Prostaglandin G/H synthase 2
External Id：CHEMBL762912
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