N-(4-bromophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
N-(4-bromophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D084-0487 |
| Compound Name: | N-(4-bromophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 355.21 |
| Molecular Formula: | C12 H11 Br N4 O2 S |
| Smiles: | Cc1c(nc(nn1)O)SCC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9119 |
| logD: | 1.9047 |
| logSw: | -2.5301 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.424 |
| InChI Key: | DZJHGENTBHDAEE-UHFFFAOYSA-N |