2-[(6-benzyl-5-hydroxy-1,2,4-triazin-3-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide
Chemical Structure Depiction of
2-[(6-benzyl-5-hydroxy-1,2,4-triazin-3-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide
2-[(6-benzyl-5-hydroxy-1,2,4-triazin-3-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide
Compound characteristics
| Compound ID: | IB03-7673 |
| Compound Name: | 2-[(6-benzyl-5-hydroxy-1,2,4-triazin-3-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide |
| Molecular Weight: | 421.3 |
| Molecular Formula: | C18 H14 Cl2 N4 O2 S |
| Smiles: | C(c1ccccc1)c1c(nc(nn1)SCC(Nc1c(cccc1[Cl])[Cl])=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.65 |
| logD: | 3.11 |
| logSw: | -4.59 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 141.68 |
| InChI Key: | NRBJVKRTSKDPFQ-UHFFFAOYSA-N |