2-[5-(4-bromophenyl)-7-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-[5-(4-bromophenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione
2-[5-(4-bromophenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | D413-0403 |
| Compound Name: | 2-[5-(4-bromophenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 498.34 |
| Molecular Formula: | C25 H16 Br N5 O2 |
| Smiles: | C1C(c2ccccc2)n2c(NC=1c1ccc(cc1)[Br])nc(n2)N1C(c2ccccc2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7952 |
| logD: | 5.7538 |
| logSw: | -5.9535 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.227 |
| InChI Key: | PCGZGWQJILEKGP-OAQYLSRUSA-N |