3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazole
3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-1516 |
| Compound Name: | 3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 377.53 |
| Molecular Formula: | C21 H19 N3 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(CSc2nnc(c3cccs3)n2c2ccccc2)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.216 |
| logD: | 6.2157 |
| logSw: | -5.6407 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.7309 |
| InChI Key: | QZVGQDNSCKLLID-UHFFFAOYSA-N |