N-[4-(4-chlorophenoxy)phenyl]-4-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide
Chemical Structure Depiction of
N-[4-(4-chlorophenoxy)phenyl]-4-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide
N-[4-(4-chlorophenoxy)phenyl]-4-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide
Compound characteristics
| Compound ID: | C200-3259 |
| Compound Name: | N-[4-(4-chlorophenoxy)phenyl]-4-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide |
| Molecular Weight: | 522.02 |
| Molecular Formula: | C26 H24 Cl N5 O3 S |
| Smiles: | CCCN1C(c2c(ccs2)n2c(CCCC(Nc3ccc(cc3)Oc3ccc(cc3)[Cl])=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0807 |
| logD: | 5.0807 |
| logSw: | -5.2188 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.872 |
| InChI Key: | FZZKZZVFPWRVHN-UHFFFAOYSA-N |