2-{[5,6-bis(4-ethoxy-3-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(butan-2-yl)acetamide
Chemical Structure Depiction of
2-{[5,6-bis(4-ethoxy-3-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(butan-2-yl)acetamide
2-{[5,6-bis(4-ethoxy-3-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(butan-2-yl)acetamide
Compound characteristics
| Compound ID: | K216-2934 |
| Compound Name: | 2-{[5,6-bis(4-ethoxy-3-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(butan-2-yl)acetamide |
| Molecular Weight: | 526.65 |
| Molecular Formula: | C27 H34 N4 O5 S |
| Smiles: | CCC(C)NC(CSc1nc(c2ccc(c(c2)OC)OCC)c(c2ccc(c(c2)OC)OCC)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8929 |
| logD: | 3.8929 |
| logSw: | -4.0088 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.251 |
| InChI Key: | IIJHEKVKWWRHOF-KRWDZBQOSA-N |