2-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione
2-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | D413-0052 |
| Compound Name: | 2-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 449.47 |
| Molecular Formula: | C26 H19 N5 O3 |
| Smiles: | COc1ccc(cc1)C1C=C(c2ccccc2)Nc2nc(nn12)N1C(c2ccccc2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8343 |
| logD: | 4.8293 |
| logSw: | -4.6336 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.771 |
| InChI Key: | LOEFIAJJJUQTND-QFIPXVFZSA-N |