5-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-1,3-dimethyl-7-(2-thienyl)pyrimido[4,5-d]pyrimidine-2,4-dione

Modify Date: 2025-08-27 16:21:14

5-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-1,3-dimethyl-7-(2-thienyl)pyrimido[4,5-d]pyrimidine-2,4-dione Structure
5-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-1,3-dimethyl-7-(2-thienyl)pyrimido[4,5-d]pyrimidine-2,4-dione structure
Common Name 5-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-1,3-dimethyl-7-(2-thienyl)pyrimido[4,5-d]pyrimidine-2,4-dione
CAS Number 847191-48-4 Molecular Weight 445.6
Density N/A Boiling Point N/A
Molecular Formula C20H23N5O3S2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 5-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-1,3-dimethyl-7-(2-thienyl)pyrimido[4,5-d]pyrimidine-2,4-dione

 Chemical & Physical Properties

Molecular Formula C20H23N5O3S2
Molecular Weight 445.6
InChIKey STWKXAONJMWEPM-UHFFFAOYSA-N
SMILES Cn1c(=O)c2c(SCC(=O)N3CCCCCC3)nc(-c3cccs3)nc2n(C)c1=O

 Bioassay

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Name: Small-molecule inhibitors of ST2 (IL1RL1)
Source: 20881
Target: interleukin-1 receptor-like 1 isoform [homo sapiens]
External Id: ST2_IL33_Inhibitors_Primary_Screening_77700
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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