3-(benzylsulfanyl)-4-ethyl-5-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-4-ethyl-5-methyl-4H-1,2,4-triazole
3-(benzylsulfanyl)-4-ethyl-5-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8013-0840 |
| Compound Name: | 3-(benzylsulfanyl)-4-ethyl-5-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 233.33 |
| Molecular Formula: | C12 H15 N3 S |
| Smiles: | CCn1c(C)nnc1SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1176 |
| logD: | 2.1174 |
| logSw: | -1.9781 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.014 |
| InChI Key: | JIXLCERIEWBUDS-UHFFFAOYSA-N |