N-(3,4-dimethoxyphenyl)-4-[4-(3-methoxypropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-4-[4-(3-methoxypropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
N-(3,4-dimethoxyphenyl)-4-[4-(3-methoxypropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
Compound characteristics
| Compound ID: | E596-0256 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-4-[4-(3-methoxypropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide |
| Molecular Weight: | 485.56 |
| Molecular Formula: | C23 H27 N5 O5 S |
| Smiles: | COCCCN1C(c2c(ccs2)n2c(CCCC(Nc3ccc(c(c3)OC)OC)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7072 |
| logD: | 1.7071 |
| logSw: | -2.5279 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.727 |
| InChI Key: | LEIBWDCUPWWSLA-UHFFFAOYSA-N |