3-(benzylsulfanyl)-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
3-(benzylsulfanyl)-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V010-4489 |
| Compound Name: | 3-(benzylsulfanyl)-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 373.48 |
| Molecular Formula: | C22 H19 N3 O S |
| Smiles: | COc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9729 |
| logD: | 4.9729 |
| logSw: | -4.7043 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | URXLXWUUPNCDBU-UHFFFAOYSA-N |