ethyl [(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]acetate
ethyl [(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 1682-3125 |
| Compound Name: | ethyl [(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]acetate |
| Molecular Weight: | 231.23 |
| Molecular Formula: | C7 H9 N3 O4 S |
| Smiles: | CCOC(CSC1C(NC(NN=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2865 |
| logD: | -0.3136 |
| logSw: | -1.456 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.484 |
| InChI Key: | BUVGJDRHELKVON-UHFFFAOYSA-N |