3-(benzylsulfanyl)-5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazole
3-(benzylsulfanyl)-5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y202-9918 |
| Compound Name: | 3-(benzylsulfanyl)-5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 360.27 |
| Molecular Formula: | C16 H14 Br N3 S |
| Smiles: | Cn1c(c2ccc(cc2)[Br])nnc1SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3733 |
| logD: | 4.3733 |
| logSw: | -4.3769 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.0508 |
| InChI Key: | QYSKOVQMNNUSSM-UHFFFAOYSA-N |