3-(benzylsulfanyl)-5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole
3-(benzylsulfanyl)-5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y020-5528 |
| Compound Name: | 3-(benzylsulfanyl)-5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole |
| Molecular Weight: | 329.85 |
| Molecular Formula: | C17 H16 Cl N3 S |
| Smiles: | CCn1c(c2ccc(cc2)[Cl])nnc1SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7487 |
| logD: | 4.7486 |
| logSw: | -5.0009 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.9655 |
| InChI Key: | LMBKYILLWYZNEC-UHFFFAOYSA-N |