2-[5-(4-methoxyphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}-1H-1,2,4-triazol-1-yl]-1,3-benzothiazole
Chemical Structure Depiction of
2-[5-(4-methoxyphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}-1H-1,2,4-triazol-1-yl]-1,3-benzothiazole
2-[5-(4-methoxyphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}-1H-1,2,4-triazol-1-yl]-1,3-benzothiazole
Compound characteristics
| Compound ID: | 5402-0562 |
| Compound Name: | 2-[5-(4-methoxyphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}-1H-1,2,4-triazol-1-yl]-1,3-benzothiazole |
| Molecular Weight: | 444.58 |
| Molecular Formula: | C24 H20 N4 O S2 |
| Smiles: | Cc1cccc(CSc2nc(c3ccc(cc3)OC)n(c3nc4ccccc4s3)n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.4656 |
| logD: | 7.4656 |
| logSw: | -5.8726 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.419 |
| InChI Key: | UMSWNBBKFTZASW-UHFFFAOYSA-N |