3-(4,5-dimethylthiophen-3-yl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4,5-dimethylthiophen-3-yl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
3-(4,5-dimethylthiophen-3-yl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-4278 |
| Compound Name: | 3-(4,5-dimethylthiophen-3-yl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 345.48 |
| Molecular Formula: | C17 H19 N3 O S2 |
| Smiles: | Cc1c(csc1C)c1nnc(n1C)SCc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1416 |
| logD: | 4.1397 |
| logSw: | -4.3717 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.613 |
| InChI Key: | VEZIBYOJTBGWLR-UHFFFAOYSA-N |