ethyl 3-[2-(hydroxymethyl)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoate
Chemical Structure Depiction of
ethyl 3-[2-(hydroxymethyl)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoate
ethyl 3-[2-(hydroxymethyl)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoate
Compound characteristics
| Compound ID: | D433-1696 |
| Compound Name: | ethyl 3-[2-(hydroxymethyl)-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoate |
| Molecular Weight: | 280.28 |
| Molecular Formula: | C12 H16 N4 O4 |
| Smiles: | CCOC(CCC1=C(C)Nc2nc(CO)nn2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1188 |
| logD: | -1.307 |
| logSw: | -1.109 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.788 |
| InChI Key: | TXEWZKAWTCEFBP-UHFFFAOYSA-N |