3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazole
3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6372 |
| Compound Name: | 3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 356.29 |
| Molecular Formula: | C14 H11 Cl2 N3 S2 |
| Smiles: | Cn1c(c2cccs2)nnc1SCc1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8545 |
| logD: | 4.8542 |
| logSw: | -4.9419 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.0691 |
| InChI Key: | MMXWZSCQMGIIKS-UHFFFAOYSA-N |