2-{[5,6-bis(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5,6-bis(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
2-{[5,6-bis(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | K216-2362 |
| Compound Name: | 2-{[5,6-bis(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 622.7 |
| Molecular Formula: | C31 H34 N4 O8 S |
| Smiles: | CCOc1ccc(cc1)NC(CSc1nc(c2cc(c(c(c2)OC)OC)OC)c(c2cc(c(c(c2)OC)OC)OC)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4906 |
| logD: | 4.4906 |
| logSw: | -4.285 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.614 |
| InChI Key: | OOWUZCXKEGZYDG-UHFFFAOYSA-N |