2,4(1H,3H)-Pyrimidinedione, 6-(ethylthio)-1-((2-hydroxyethoxy)methyl)-5-methyl-
Basic information
- CAS
125056-72-6- Standard SMILES
CCSc1c(C)c(=O)[nH]c(=O)n1COCCO- InChIKey
YNMMZRKISFEJKG-UHFFFAOYSA-N- Molecular formula
- C10H16N2O4S
- Average molar mass
- 260.31 g/mol
- Monoisotopic mass
- 260.08307817
Names & identifiers
- Preferred name
- 2,4(1H,3H)-Pyrimidinedione, 6-(ethylthio)-1-((2-hydroxyethoxy)methyl)-5-methyl-
- IUPAC
- 6-ethylsulfanyl-1-(2-hydroxyethoxymethyl)-5-methylpyrimidine-2,4-dione
Names & synonyms
6EtS-1-(2-OHEtOMe)T125056-72-62,4(1H,3H)-Pyrimidinedione, 6-(ethylthio)-1-((2-hydroxyethoxy)methyl)-5-methyl-6-Ethylthio-1-((2-hydroxyethoxy)methyl)thymine6-Ethylthio-1-[(2-hydroxyethoxy)methyl]thymine2,4(1H,3H)-Pyrimidinedione, 6-(ethylthio)-1-[(2-hydroxyethoxy)methyl]-5-methyl-CHEMBL432030DTXSID501546036-ethylsulfanyl-1-(2-hydroxyethoxymethyl)-5-methyl-pyrimidine-2,4-dione6-(Ethylsulfanyl)-1-[(2-hydroxyethoxy)methyl]-5-methylpyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
125056-72-6- PubChem CID
- 452898
- DTXSID
DTXSID50154603- ChEMBL
CHEMBL432030- Nikkaji
- J362.127H
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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