2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]acetamide
Chemical Structure Depiction of
2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]acetamide
2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]acetamide
Compound characteristics
| Compound ID: | Y041-7481 |
| Compound Name: | 2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]acetamide |
| Molecular Weight: | 396.4 |
| Molecular Formula: | C20 H20 N4 O5 |
| Smiles: | CC1(C)CC(c2c(cc(cc2O1)OCC(NCc1nnc2ccccn12)=O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.872 |
| logD: | 0.8714 |
| logSw: | -2.1119 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.653 |
| InChI Key: | NKKHZFKLTSQZNO-UHFFFAOYSA-N |