1-(butylsulfanyl)-4-[(thiophen-2-yl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-(butylsulfanyl)-4-[(thiophen-2-yl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-(butylsulfanyl)-4-[(thiophen-2-yl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0467 |
| Compound Name: | 1-(butylsulfanyl)-4-[(thiophen-2-yl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 376.52 |
| Molecular Formula: | C16 H16 N4 O S3 |
| Smiles: | CCCCSc1nnc2N(Cc3cccs3)C(c3c(ccs3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2998 |
| logD: | 4.2998 |
| logSw: | -4.1422 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.62 |
| InChI Key: | CQRSPKYDYXMDIV-UHFFFAOYSA-N |