2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2-chlorophenyl)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]-N-(2-chlorophenyl)acetamide
2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | D035-0134 |
| Compound Name: | 2-[(3-benzyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]-N-(2-chlorophenyl)acetamide |
| Molecular Weight: | 443.93 |
| Molecular Formula: | C19 H14 Cl N5 O2 S2 |
| Smiles: | C(C1C(N2C(=NN=1)SC(=N2)SCC(Nc1ccccc1[Cl])=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0577 |
| logD: | 4.0553 |
| logSw: | -4.2316 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.6 |
| InChI Key: | LLGKLESNKYNTHQ-UHFFFAOYSA-N |