3-(1-benzothiophen-3-yl)-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(1-benzothiophen-3-yl)-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
3-(1-benzothiophen-3-yl)-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6389 |
| Compound Name: | 3-(1-benzothiophen-3-yl)-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 406.35 |
| Molecular Formula: | C18 H13 Cl2 N3 S2 |
| Smiles: | Cn1c(c2csc3ccccc23)nnc1SCc1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.8953 |
| logD: | 5.8953 |
| logSw: | -6.2505 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.7976 |
| InChI Key: | PBICXURIRCPGPK-UHFFFAOYSA-N |