3-(benzylsulfanyl)-5-(4-methoxyphenyl)-4-(3-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-5-(4-methoxyphenyl)-4-(3-methylphenyl)-4H-1,2,4-triazole
3-(benzylsulfanyl)-5-(4-methoxyphenyl)-4-(3-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V007-2270 |
| Compound Name: | 3-(benzylsulfanyl)-5-(4-methoxyphenyl)-4-(3-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 387.5 |
| Molecular Formula: | C23 H21 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2ccc(cc2)OC)nnc1SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5621 |
| logD: | 5.5621 |
| logSw: | -5.607 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | MXPCMHJVXYZSRJ-UHFFFAOYSA-N |