3-{[(3-chlorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3-chlorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole
3-{[(3-chlorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6423 |
| Compound Name: | 3-{[(3-chlorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 345.85 |
| Molecular Formula: | C17 H16 Cl N3 O S |
| Smiles: | Cn1c(c2ccc(cc2)OC)nnc1SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4548 |
| logD: | 4.4548 |
| logSw: | -4.5845 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.595 |
| InChI Key: | FMTCJBBHFZUMDI-UHFFFAOYSA-N |