2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(pyrimidin-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(pyrimidin-2-yl)acetamide
2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(pyrimidin-2-yl)acetamide
Compound characteristics
Compound ID: | 8009-2664 |
Compound Name: | 2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(pyrimidin-2-yl)acetamide |
Molecular Weight: | 379.44 |
Molecular Formula: | C18 H17 N7 O S |
Smiles: | CCCn1c2ccccc2c2c1nc(nn2)SCC(Nc1ncccn1)=O |
Stereo: | ACHIRAL |
logP: | 2.2123 |
logD: | 2.2108 |
logSw: | -2.6962 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.676 |
InChI Key: | UHAOHBUKFTWMLL-UHFFFAOYSA-N |