N-benzyl-2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}acetamide
N-benzyl-2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8015-2823 |
| Compound Name: | N-benzyl-2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 386.48 |
| Molecular Formula: | C17 H22 N8 O S |
| Smiles: | CCNc1nc(NCC)n2c(nnc2n1)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1248 |
| logD: | 2.1169 |
| logSw: | -2.5056 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.481 |
| InChI Key: | UURHNMGXVGNEMS-UHFFFAOYSA-N |