1-(butylsulfanyl)-4-[(2-methoxyphenyl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-(butylsulfanyl)-4-[(2-methoxyphenyl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-(butylsulfanyl)-4-[(2-methoxyphenyl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0367 |
| Compound Name: | 1-(butylsulfanyl)-4-[(2-methoxyphenyl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 400.52 |
| Molecular Formula: | C19 H20 N4 O2 S2 |
| Smiles: | CCCCSc1nnc2N(Cc3ccccc3OC)C(c3c(ccs3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5954 |
| logD: | 4.5954 |
| logSw: | -4.3481 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.232 |
| InChI Key: | PIOVKAHXVINGHK-UHFFFAOYSA-N |