4-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[(thiophen-2-yl)methyl]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-[(thiophen-2-yl)methyl]butanamide
4-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[(thiophen-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | E596-1104 |
| Compound Name: | 4-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[(thiophen-2-yl)methyl]butanamide |
| Molecular Weight: | 415.53 |
| Molecular Formula: | C19 H21 N5 O2 S2 |
| Smiles: | CCCN1C(c2c(ccs2)n2c(CCCC(NCc3cccs3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4427 |
| logD: | 2.4427 |
| logSw: | -2.6669 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.464 |
| InChI Key: | OVIRPTQTGGQJOT-UHFFFAOYSA-N |