[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]acetic acid
Chemical Structure Depiction of
[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]acetic acid
[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | 1682-0040 |
| Compound Name: | [(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]acetic acid |
| Molecular Weight: | 203.17 |
| Molecular Formula: | C5 H5 N3 O4 S |
| Smiles: | C(C(O)=O)SC1C(NC(NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.4081 |
| logD: | -4.0845 |
| logSw: | -1.3305 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.71 |
| InChI Key: | DIALFHUPRSIJKT-UHFFFAOYSA-N |