dimethyl 2-(1-butanoyl-2,2,6-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate

Modify Date: 2025-10-01 07:54:16

dimethyl 2-(1-butanoyl-2,2,6-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate Structure
dimethyl 2-(1-butanoyl-2,2,6-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate structure
Common Name dimethyl 2-(1-butanoyl-2,2,6-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
CAS Number 303051-01-6 Molecular Weight 491.643
Density 1.4±0.1 g/cm3 Boiling Point 631.8±65.0 °C at 760 mmHg
Molecular Formula C23H25NO5S3 Melting Point N/A
MSDS N/A Flash Point 335.9±34.3 °C

 Names

Name Dimethyl 2-(1-butyryl-2,2,6-trimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 631.8±65.0 °C at 760 mmHg
Molecular Formula C23H25NO5S3
Molecular Weight 491.643
Flash Point 335.9±34.3 °C
Exact Mass 491.089478
LogP 5.66
Vapour Pressure 0.0±1.9 mmHg at 25°C
Index of Refraction 1.654
InChIKey MJMGWSLMSGWRDI-UHFFFAOYSA-N
SMILES CCCC(=O)N1c2ccc(C)cc2C(=C2SC(C(=O)OC)=C(C(=O)OC)S2)C(=S)C1(C)C

 Bioassay

View more

Name: Dicer-mediated maturation of pre-microRNA
Source: Center for Chemical Genomics, University of Michigan
Target: N/A
External Id: TargetID_659_CEMA
Name: Inhibitors of CDC25B-CDK2/CyclinA interaction
Source: Center for Chemical Genomics, University of Michigan
External Id: MScreen:TargetID_600
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
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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 Synonyms

Dimethyl 2-(1-butyryl-2,2,6-trimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
1,3-Dithiole-4,5-dicarboxylic acid, 2-[2,3-dihydro-2,2,6-trimethyl-1-(1-oxobutyl)-3-thioxo-4(1H)-quinolinylidene]-, dimethyl ester
Dimethyl 2-(1-butyryl-2,2,6-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
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