1-(butylsulfanyl)-4-(2-phenylethyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-(butylsulfanyl)-4-(2-phenylethyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-(butylsulfanyl)-4-(2-phenylethyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
Compound ID: | F401-0274 |
Compound Name: | 1-(butylsulfanyl)-4-(2-phenylethyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
Molecular Weight: | 384.52 |
Molecular Formula: | C19 H20 N4 O S2 |
Smiles: | CCCCSc1nnc2N(CCc3ccccc3)C(c3c(ccs3)n12)=O |
Stereo: | ACHIRAL |
logP: | 4.7424 |
logD: | 4.7424 |
logSw: | -4.4184 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.58 |
InChI Key: | YFUDKVUWGZUFBE-UHFFFAOYSA-N |