N-benzyl-2-{[5,6-bis(4-ethoxy-3-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[5,6-bis(4-ethoxy-3-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}acetamide
N-benzyl-2-{[5,6-bis(4-ethoxy-3-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K216-2925 |
| Compound Name: | N-benzyl-2-{[5,6-bis(4-ethoxy-3-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 560.67 |
| Molecular Formula: | C30 H32 N4 O5 S |
| Smiles: | CCOc1ccc(cc1OC)c1c(c2ccc(c(c2)OC)OCC)nnc(n1)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.427 |
| logD: | 4.427 |
| logSw: | -4.3417 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.538 |
| InChI Key: | MZHWYWCAOZJEEV-UHFFFAOYSA-N |