2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[(2-chlorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[(2-chlorophenyl)methyl]acetamide
2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[(2-chlorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K216-2565 |
| Compound Name: | 2-{[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[(2-chlorophenyl)methyl]acetamide |
| Molecular Weight: | 567.06 |
| Molecular Formula: | C28 H27 Cl N4 O5 S |
| Smiles: | COc1ccc(cc1OC)c1c(c2ccc(c(c2)OC)OC)nnc(n1)SCC(NCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5178 |
| logD: | 4.5178 |
| logSw: | -4.6301 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.378 |
| InChI Key: | XSEUFSSYJPMKOB-UHFFFAOYSA-N |