1-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | C200-2776 |
| Compound Name: | 1-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 466.56 |
| Molecular Formula: | C23 H26 N6 O3 S |
| Smiles: | CN1C(c2c(ccs2)n2c(CCCC(N3CCN(CC3)c3ccc(cc3)OC)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8851 |
| logD: | 1.8847 |
| logSw: | -2.4106 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.959 |
| InChI Key: | YLPOFFUGEURXIU-UHFFFAOYSA-N |