4-(3-methoxypropyl)-1-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-(3-methoxypropyl)-1-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-(3-methoxypropyl)-1-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | E596-0322 |
| Compound Name: | 4-(3-methoxypropyl)-1-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 494.62 |
| Molecular Formula: | C25 H30 N6 O3 S |
| Smiles: | COCCCN1C(c2c(ccs2)n2c(CCCC(N3CCN(CC3)c3ccccc3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2133 |
| logD: | 2.2132 |
| logSw: | -2.3872 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.97 |
| InChI Key: | TXOHQXFDADVJPJ-UHFFFAOYSA-N |