N-(4-methoxyphenyl)-2-({5-[(4-methylanilino)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-2-({5-[(4-methylanilino)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(4-methoxyphenyl)-2-({5-[(4-methylanilino)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | 8012-9631 |
| Compound Name: | N-(4-methoxyphenyl)-2-({5-[(4-methylanilino)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 473.6 |
| Molecular Formula: | C26 H27 N5 O2 S |
| Smiles: | Cc1ccc(cc1)NCc1nnc(n1c1ccccc1C)SCC(Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9711 |
| logD: | 4.9711 |
| logSw: | -4.5619 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.587 |
| InChI Key: | KJSPYQSUEJFTGE-UHFFFAOYSA-N |