6-amino-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-4-one

Modify Date: 2025-09-15 20:34:13

6-amino-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-4-one Structure
6-amino-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-4-one structure
Common Name 6-amino-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-4-one
CAS Number 166751-35-5 Molecular Weight 247.31600
Density 1.33g/cm3 Boiling Point 407.6ºC at 760 mmHg
Molecular Formula C12H13N3OS Melting Point N/A
MSDS N/A Flash Point 200.3ºC

 Names

Name 6-amino-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-4-one

 Chemical & Physical Properties

Density 1.33g/cm3
Boiling Point 407.6ºC at 760 mmHg
Molecular Formula C12H13N3OS
Molecular Weight 247.31600
Flash Point 200.3ºC
Exact Mass 247.07800
PSA 97.07000
LogP 2.53400
Vapour Pressure 7.45E-07mmHg at 25°C
Index of Refraction 1.667
InChIKey OQQZKAPKMXBJSE-UHFFFAOYSA-N
SMILES Cc1ccc(CSc2nc(N)cc(=O)[nH]2)cc1

 Safety Information

HS Code 2933599090

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2933599090
Summary 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Bioassay

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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
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Antagonist activity at 20% inactivated human sodium channel Nav1.7 expressed in human...
Source: ChEMBL
Target: Sodium channel protein type 9 subunit alpha
External Id: CHEMBL1942850
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Intrinsic clearance in rat liver microsomes assessed as per mg of tissue
Source: ChEMBL
Target: Liver microsomes
External Id: CHEMBL1942856
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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