N-{[4-(methylsulfanyl)phenyl]methyl}-3-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-3-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
N-{[4-(methylsulfanyl)phenyl]methyl}-3-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
Compound characteristics
| Compound ID: | C200-7677 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-3-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C21 H23 N5 O2 S2 |
| Smiles: | CCCN1C(c2c(ccs2)n2c(CCC(NCc3ccc(cc3)SC)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0187 |
| logD: | 3.0187 |
| logSw: | -3.3431 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.446 |
| InChI Key: | CEZUFJJOGFQAQT-UHFFFAOYSA-N |