2-({5-[(4-tert-butylphenoxy)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-({5-[(4-tert-butylphenoxy)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide
2-({5-[(4-tert-butylphenoxy)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | 8013-9128 |
| Compound Name: | 2-({5-[(4-tert-butylphenoxy)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide |
| Molecular Weight: | 500.66 |
| Molecular Formula: | C29 H32 N4 O2 S |
| Smiles: | Cc1ccc(cc1)NC(CSc1nnc(COc2ccc(cc2)C(C)(C)C)n1c1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7827 |
| logD: | 6.7826 |
| logSw: | -5.6701 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.036 |
| InChI Key: | OMDFOSBACCEGFB-UHFFFAOYSA-N |