2-({4-benzyl-5-[(1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
Chemical Structure Depiction of
2-({4-benzyl-5-[(1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
2-({4-benzyl-5-[(1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
Compound characteristics
| Compound ID: | K822-0305 |
| Compound Name: | 2-({4-benzyl-5-[(1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide |
| Molecular Weight: | 522.46 |
| Molecular Formula: | C26 H21 Cl2 N5 O S |
| Smiles: | C(c1c[nH]c2ccccc12)c1nnc(n1Cc1ccccc1)SCC(Nc1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2935 |
| logD: | 6.2853 |
| logSw: | -6.3578 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.965 |
| InChI Key: | CUORCKOZLOYMOK-UHFFFAOYSA-N |