2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D035-0127 |
| Compound Name: | 2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamide |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C13 H11 N5 O2 S2 |
| Smiles: | C(C1C(N2C(=NN=1)SC(=N2)SCC(N)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8458 |
| logD: | 1.8358 |
| logSw: | -2.0931 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.807 |
| InChI Key: | RXMJVMIFXBODLK-UHFFFAOYSA-N |