3-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
3-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V009-9857 |
| Compound Name: | 3-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C25 H25 N3 O3 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(CSc2nnc(c3cc(cc(c3)OC)OC)n2c2ccc(cc2)OC)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.9856 |
| logD: | 5.9856 |
| logSw: | -5.5923 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.344 |
| InChI Key: | FXIUXMJCUKRJFC-UHFFFAOYSA-N |