3-(3,5-dimethoxyphenyl)-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(3,5-dimethoxyphenyl)-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazole
3-(3,5-dimethoxyphenyl)-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V010-1981 |
| Compound Name: | 3-(3,5-dimethoxyphenyl)-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C26 H27 N3 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c(c2cc(cc(c2)OC)OC)nnc1SCc1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 7.0076 |
| logD: | 7.0076 |
| logSw: | -5.6351 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.8 |
| InChI Key: | QQCOPJHYKDDACY-UHFFFAOYSA-N |