3-(4,5-dimethylthiophen-3-yl)-4-methyl-5-{[(4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4,5-dimethylthiophen-3-yl)-4-methyl-5-{[(4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
3-(4,5-dimethylthiophen-3-yl)-4-methyl-5-{[(4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-4944 |
| Compound Name: | 3-(4,5-dimethylthiophen-3-yl)-4-methyl-5-{[(4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 329.48 |
| Molecular Formula: | C17 H19 N3 S2 |
| Smiles: | Cc1ccc(CSc2nnc(c3csc(C)c3C)n2C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.232 |
| logD: | 4.2302 |
| logSw: | -4.3338 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.0691 |
| InChI Key: | MIEDAPSLRJZSBZ-UHFFFAOYSA-N |