1-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-4-pentylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-4-pentylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-4-pentylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F084-0418 |
| Compound Name: | 1-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-4-pentylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C24 H29 N7 O2 S |
| Smiles: | CCCCCN1C(c2c(ccs2)n2c(CCC(N3CCN(CC3)c3ccccn3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3168 |
| logD: | 3.3079 |
| logSw: | -3.5663 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.139 |
| InChI Key: | ISPVRKYEQMMYDN-UHFFFAOYSA-N |