3-(3-methoxyphenyl)-5-{[(2-methoxyphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(3-methoxyphenyl)-5-{[(2-methoxyphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
3-(3-methoxyphenyl)-5-{[(2-methoxyphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V001-4812 |
| Compound Name: | 3-(3-methoxyphenyl)-5-{[(2-methoxyphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1nnc(n1c1ccccc1)SCc1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.4326 |
| logD: | 5.4326 |
| logSw: | -5.5568 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.887 |
| InChI Key: | XCYQZICULBWXTC-UHFFFAOYSA-N |