N-[(oxolan-2-yl)methyl]-2-[(7-oxo-5-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-2-[(7-oxo-5-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetamide
N-[(oxolan-2-yl)methyl]-2-[(7-oxo-5-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G856-6803 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-2-[(7-oxo-5-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 385.44 |
| Molecular Formula: | C18 H19 N5 O3 S |
| Smiles: | C1CC(CNC(CSc2nnc3NC(C=C(c4ccccc4)n23)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.738 |
| logD: | 0.7311 |
| logSw: | -2.0547 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.96 |
| InChI Key: | IEBUOTSFNMAPKT-CYBMUJFWSA-N |