N-(4-bromophenyl)-2-({5-[(4-chloroanilino)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-({5-[(4-chloroanilino)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(4-bromophenyl)-2-({5-[(4-chloroanilino)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | 8012-7285 |
| Compound Name: | N-(4-bromophenyl)-2-({5-[(4-chloroanilino)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 542.88 |
| Molecular Formula: | C24 H21 Br Cl N5 O S |
| Smiles: | Cc1ccccc1n1c(CNc2ccc(cc2)[Cl])nnc1SCC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.994 |
| logD: | 5.9939 |
| logSw: | -6.0506 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.043 |
| InChI Key: | DSJNCDPIGPUISY-UHFFFAOYSA-N |