4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]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-[2-(4-sulfamoylphenyl)ethyl]butanamide
4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide
Compound characteristics
| Compound ID: | E596-0456 |
| Compound Name: | 4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide |
| Molecular Weight: | 488.59 |
| Molecular Formula: | C21 H24 N6 O4 S2 |
| Smiles: | CCN1C(c2c(ccs2)n2c(CCCC(NCCc3ccc(cc3)S(N)(=O)=O)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1136 |
| logD: | 0.1128 |
| logSw: | -2.2381 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.637 |
| InChI Key: | CYOQUDVSBOJVRA-UHFFFAOYSA-N |