3-phenyl-7-(2-phenylethyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Chemical Structure Depiction of
3-phenyl-7-(2-phenylethyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
3-phenyl-7-(2-phenylethyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Compound characteristics
| Compound ID: | D727-0271 |
| Compound Name: | 3-phenyl-7-(2-phenylethyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one |
| Molecular Weight: | 334.4 |
| Molecular Formula: | C18 H14 N4 O S |
| Smiles: | C(Cc1ccccc1)C1=NN2C(=NN=C(C2=O)c2ccccc2)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.2535 |
| logD: | 4.2449 |
| logSw: | -4.4106 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.729 |
| InChI Key: | QYFXMKRBOIQGLK-UHFFFAOYSA-N |