7-(4-methoxyphenyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Chemical Structure Depiction of
7-(4-methoxyphenyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
7-(4-methoxyphenyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Compound characteristics
| Compound ID: | D727-0264 |
| Compound Name: | 7-(4-methoxyphenyl)-3-phenyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one |
| Molecular Weight: | 336.37 |
| Molecular Formula: | C17 H12 N4 O2 S |
| Smiles: | COc1ccc(cc1)C1=NN2C(=NN=C(C2=O)c2ccccc2)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.4722 |
| logD: | 3.4712 |
| logSw: | -3.6797 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.369 |
| InChI Key: | BOTVKXLBUBHIRP-UHFFFAOYSA-N |