methyl 4-[(7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methoxy]benzoate
Chemical Structure Depiction of
methyl 4-[(7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methoxy]benzoate
methyl 4-[(7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methoxy]benzoate
Compound characteristics
| Compound ID: | 8018-5613 |
| Compound Name: | methyl 4-[(7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methoxy]benzoate |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C14 H12 N4 O4 |
| Smiles: | COC(c1ccc(cc1)OCC1=CC(n2c(N1)ncn2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2248 |
| logD: | -0.1423 |
| logSw: | -1.9895 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.954 |
| InChI Key: | OIIKLBJRZWWEGA-UHFFFAOYSA-N |