2-[(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
2-[(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | F798-0171 |
| Compound Name: | 2-[(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 455.6 |
| Molecular Formula: | C22 H25 N5 O2 S2 |
| Smiles: | CCCN1C(c2c(ccs2)n2c1nnc2SCC(NC(C)CCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9205 |
| logD: | 3.9205 |
| logSw: | -3.845 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.493 |
| InChI Key: | IIYFPLSMVXNIST-HNNXBMFYSA-N |