4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-(4-phenoxyphenyl)butanamide
Chemical Structure Depiction of
4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-(4-phenoxyphenyl)butanamide
4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-(4-phenoxyphenyl)butanamide
Compound characteristics
| Compound ID: | E596-0357 |
| Compound Name: | 4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-(4-phenoxyphenyl)butanamide |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C25 H23 N5 O3 S |
| Smiles: | CCN1C(c2c(ccs2)n2c(CCCC(Nc3ccc(cc3)Oc3ccccc3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9681 |
| logD: | 3.9681 |
| logSw: | -4.0647 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.618 |
| InChI Key: | UEKFWQXBQIPKBA-UHFFFAOYSA-N |