4-(5-oxo-4-propyl-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-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide
4-(5-oxo-4-propyl-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: | C200-3191 |
| Compound Name: | 4-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]butanamide |
| Molecular Weight: | 502.61 |
| Molecular Formula: | C22 H26 N6 O4 S2 |
| Smiles: | CCCN1C(c2c(ccs2)n2c(CCCC(NCCc3ccc(cc3)S(N)(=O)=O)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6029 |
| logD: | 0.6022 |
| logSw: | -2.211 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.891 |
| InChI Key: | LFSQRPXJJXGTCJ-UHFFFAOYSA-N |