2-{[5,6-bis(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
Chemical Structure Depiction of
2-{[5,6-bis(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
2-{[5,6-bis(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | K216-2388 |
| Compound Name: | 2-{[5,6-bis(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide |
| Molecular Weight: | 606.7 |
| Molecular Formula: | C31 H34 N4 O7 S |
| Smiles: | CCc1ccccc1NC(CSc1nc(c2cc(c(c(c2)OC)OC)OC)c(c2cc(c(c(c2)OC)OC)OC)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6211 |
| logD: | 4.6211 |
| logSw: | -4.2982 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.792 |
| InChI Key: | CKMNKNGRJGTGQZ-UHFFFAOYSA-N |