3,6-bis{[(3-bromophenyl)methyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3,6-bis{[(3-bromophenyl)methyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3,6-bis{[(3-bromophenyl)methyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8009-1594 |
| Compound Name: | 3,6-bis{[(3-bromophenyl)methyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 528.31 |
| Molecular Formula: | C17 H12 Br2 N4 S3 |
| Smiles: | C(c1cccc(c1)[Br])Sc1nnc2n1nc(SCc1cccc(c1)[Br])s2 |
| Stereo: | ACHIRAL |
| logP: | 5.9306 |
| logD: | 5.9306 |
| logSw: | -6.2302 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.665 |
| InChI Key: | KPOGKPXSUVVXIO-UHFFFAOYSA-N |