3-Ethylsulfanyl-5H-pyrimido(4,5-E)(1,2,4)triazine-6,8-dione
3-ethylsulfanyl-5H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione
Also Known As: ChemDiv3_014672|Oprea1_350083|Oprea1_798387|IDI1_030470|3-(ethylsulfanyl)-5H,6H,7H,8H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione|AB00979382-01|3-(ethylthio)pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione|3-ethylsulfanyl-5H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione|3-(Ethylthio)pyrimido[4,5-e][1,2,4]triazine-6,8-diol|7-Ethylthio-1,2,3,4-tetrahydropyrimido-[4,5-b]-1,2,4-triazine-2,4-dione|3-ethylsulfanyl-2H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione|3-Ethylsulfanyl-5H-pyrimido(4,5-E)(1,2,4)triazine-6,8-dione|666-023-9
| Molecular Formula | C7H7N5O2S |
|---|---|
| Molecular Weight | 225.03204 g/mol |
| LogP | -0.4866 |
| Topological Polar Surface Area | 104.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.03204 |
| Monoisotopic Mass | 225.03204 |
| Heavy Atoms | 15 |
| Complexity | 604.0874 |
Chemical Identifiers
| CAS Number | 7271-92-3 |
|---|---|
| SMILES | CCSC1=NC2=C(C(=O)NC(=O)N2)N=N1 |
Product Overview
3-Ethylsulfanyl-5H-pyrimido(4,5-E)(1,2,4)triazine-6,8-dione (CAS 7271-92-3), with molecular formula C7H7N5O2S and molecular weight 225.03204 g/mol. IUPAC: 3-ethylsulfanyl-5H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione.