2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | 8015-3004 |
| Compound Name: | 2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide |
| Molecular Weight: | 402.48 |
| Molecular Formula: | C17 H22 N8 O2 S |
| Smiles: | CCNc1nc(NCC)n2c(nnc2n1)SCC(Nc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1965 |
| logD: | 2.1886 |
| logSw: | -2.6827 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.091 |
| InChI Key: | LDHDHGJQNNUDMF-UHFFFAOYSA-N |