3-(4-Fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one
3-(4-Fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one structure
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Common Name | 3-(4-Fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one | ||
|---|---|---|---|---|
| CAS Number | 387-27-9 | Molecular Weight | 227.27800 | |
| Density | 1.53g/cm3 | Boiling Point | 339ºC at 760mmHg | |
| Molecular Formula | C9H6FNOS2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 158.9ºC | |
Summary: 3-(4-Fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one (Chinese name: 3-(4-氟苯基)-2-硫基氧代-1,3-噻唑烷-4-酮，CAS number: 387-27-9)，molecular formula: C9H6FNOS2，molecular weight: 227.27800，For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.53g/cm3 |
|---|---|
| Boiling Point | 339ºC at 760mmHg |
| Molecular Formula | C9H6FNOS2 |
| Molecular Weight | 227.27800 |
| Flash Point | 158.9ºC |
| Exact Mass | 226.98700 |
| PSA | 77.70000 |
| LogP | 2.25540 |
| Index of Refraction | 1.707 |
| InChIKey | KQOPBWMREOTAOQ-UHFFFAOYSA-N |
| SMILES | O=C1CSC(=S)N1c1ccc(F)cc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi: Irritant; |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~74%
3-(4-Fluorophen... CAS#:387-27-9 |
| Literature: MICROBIOTIX, INC. Patent: WO2009/142720 A1, 2009 ; Location in patent: Page/Page column 31-32 ; |
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~39%
3-(4-Fluorophen... CAS#:387-27-9 |
| Literature: Nitsche, Christoph; Schreier, Verena N.; Behnam, Mira A. M.; Kumar, Anil; Bartenschlager, Ralf; Klein, Christian D. Journal of Medicinal Chemistry, 2013 , vol. 56, # 21 p. 8389 - 8403 |
![Acetic acid,2,2'-[carbonothioylbis(thio)]bis structure](https://image.chemsrc.com/caspic/324/6326-83-6.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
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| DownStream 0 | |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Fluorescence-based counterscreen for orexin 1 receptor (OX1R) antagonists: cell-based...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: CHOK1_ANT_FLUO8_1536_1X%INH CSRUN
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Name: qHTS Assay for Inhibitors of the Phosphatase Activity of Eya2
Source: NCGC
Target: eyes absent homolog 2 isoform a [Homo sapiens]
External Id: EYA2477
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Name: Absorbance-based primary biochemical high throughput screening assay to identify acti...
Source: The Scripps Research Institute Molecular Screening Center
Target: caspase-3 preproprotein [Homo sapiens]
External Id: PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: Primary cell-based high-throughput screening for identification of compounds that all...
Source: Johns Hopkins Ion Channel Center
Target: MAS-related GPR member X1 [Homo sapiens]
External Id: JHICC_MrgX1_AlloAgonist_Primary
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Name: uHTS identification of small molecule inhibitors of tim23-1 yeast via a luminescent a...
Source: Burnham Center for Chemical Genomics
Target: TPA: Essential component of the Translocase of the Inner Mitochondrial membrane (TIM23 complex); involved in protein import into mitochondrial matrix and inner membrane; with Tim17p, contributes to architecture and function of the import channel [Saccharomyces cerevisiae S288c]
External Id: SBCCG-A419-tim23-1-Primary-Antagonist-Assay
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Name: Primary cell-based high-throughput screening for identification of compounds that ant...
Source: Johns Hopkins Ion Channel Center
Target: MAS-related GPR member X1 [Homo sapiens]
External Id: JHICC_MrgX1_Antagonist_Primary
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Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: 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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Name: Counterscreen for procaspase-3 activators: absorbance-based primary biochemical high ...
Source: The Scripps Research Institute Molecular Screening Center
Target: caspase 7, apoptosis-related cysteine peptidase [Homo sapiens]
External Id: PROCASPASE7_ACT_EPIABS_1536_1X%ACT CSRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-fluorophenyl rhodanine |
| 3-(4-Fluorophenyl)rhodanine |
| 3-(4-Fluor-phenyl)-2-thioxo-thiazolidin-4-on |
| fluorophenylthioxothiazolanone |
| 3-(4-fluorophenyl)-2-thioxothiazolidin-4-one |
| 3-(4-fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one |
| 3-(4'-Fluorphenyl)-rhodanin |
| 3-(4-fluorophenyl)-2-thioxo-1,3-thiazolan-4-one |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: The English name of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one. |
| Q: What is the SMILES notation of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: SMILES notation of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is O=C1CSC(=S)N1c1ccc(F)cc1. |
| Q: What is the molecular weight of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: Molecular weight of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is 227.27800. |
| Q: What English synonyms does 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one have? |
| A: English synonyms of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one: 4-fluorophenyl rhodanine, 3-(4-Fluorophenyl)rhodanine, 3-(4-Fluor-phenyl)-2-thioxo-thiazolidin-4-on, fluorophenylthioxothiazolanone, 3-(4-fluorophenyl)-2-thioxothiazolidin-4-one, 3-(4-fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one, 3-(4'-Fluorphenyl)-rhodanin, 3-(4-fluorophenyl)-2-thioxo-1,3-thiazolan-4-one. |
| Q: What is the InChIKey of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: InChIKey of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is KQOPBWMREOTAOQ-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: Molecular formula of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is C9H6FNOS2. |
| Q: What is the LogP of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: LogP of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is 2.25540. |
| Q: What is the boiling point of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: Boiling point of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is 339ºC at 760mmHg. |
| Q: What is the CAS number of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: CAS number of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is 387-27-9. |
| Q: What are the upstream materials of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one? |
| A: Related upstream materials(CAS) of 3-(4-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one: 2365-48-2;1544-68-9;6326-83-6;371-40-4. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |