2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-phenylacetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-phenylacetamide
2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-phenylacetamide
Compound characteristics
Compound ID: | G786-1981 |
Compound Name: | 2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-phenylacetamide |
Molecular Weight: | 409.49 |
Molecular Formula: | C19 H15 N5 O2 S2 |
Smiles: | C(C1C(N2C(=NN=1)SC(=N2)SCC(Nc1ccccc1)=O)=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.8152 |
logD: | 3.8129 |
logSw: | -4.0988 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.297 |
InChI Key: | SFMVLNZUIRBOFM-UHFFFAOYSA-N |