Basic information
- CAS
20651-30-3- Standard SMILES
CSc1ncc(C)c(=O)[nH]1- InChIKey
TVPRITKRWWSQFW-UHFFFAOYSA-N- Molecular formula
- C6H8N2OS
- Average molar mass
- 156.21 g/mol
- Monoisotopic mass
- 156.03573388
Names & identifiers
- Preferred name
- 5-Methyl-2-(methylthio)pyrimidin-4(3H)-one
- IUPAC
- 5-methyl-2-methylsulfanyl-1H-pyrimidin-6-one
- English name
- 4(3H)-Pyrimidinone, 5-methyl-2-(methylthio)-
- Molecular formula
- C6H8N2OS
- Molecular weight
- 156.21
Names & synonyms
20651-30-35-Methyl-2-(methylthio)pyrimidin-4(3H)-one5-methyl-2-methylsulfanyl-1H-pyrimidin-6-one5-methyl-2-(methylthio)pyrimidin-4-ol4-Hydroxy-5-methyl-2-(methylthio)pyrimidineMFCD001949614(1H)-Pyrimidinone, 5-methyl-2-(methylthio)-4(3H)-Pyrimidinone, 5-methyl-2-(methylthio)-MFCD120246762-(methylthio)-5-methylpyrimidin-4(1H)-one5-methyl-2-(methylsulfanyl)pyrimidin-4(3h)-oneNSC46972
Show more names
1061785-Methyl-2-(methylthio)-4(3H)-pyrimidinone5-methyl-2-(methylthio)pyrimidin-4(1H)-one
5-Methyl-2-methylthio-4(1H)-pyrimidinone2-(Methylthio)-5-methylpyrimidine-4(1H)-one4(3H)-Pyrimidinone,5-methyl-2-(methylthio)-5-METHYL-2-(METHYLSULFANYL)PYRIMIDIN-4-OLorb3029756SCHEMBL3577936SCHEMBL3966185SCHEMBL9104605
Database identifiers
- CAS
20651-30-3- PubChem CID
- 240575
- DTXSID
DTXSID80286663
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 220
Physicochemical properties
- storage temp.
- 2 · 2-8°C(protect from light)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317-H319
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2933599590 · 2933599590
Safety & regulation
Safety data
- hs_code
- 2933599590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H317-H319
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers24 total
上海埃逸科技有限公司13916181326 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
南京药石科技股份有限公司025-86918202 4000255188 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
无锡捷化医药科技有限公司83588313 18800520310 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Related reactions
8 records
Compound notes
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