1-[5-(4-bromophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione
Chemical Structure Depiction of
1-[5-(4-bromophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione
1-[5-(4-bromophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | D413-0305 |
| Compound Name: | 1-[5-(4-bromophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione |
| Molecular Weight: | 480.32 |
| Molecular Formula: | C22 H18 Br N5 O3 |
| Smiles: | COc1ccc(cc1)C1C=C(c2ccc(cc2)[Br])Nc2nc(nn12)N1C(CCC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3425 |
| logD: | 3.3402 |
| logSw: | -3.5001 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.598 |
| InChI Key: | ORSHASBOSZNMPQ-GOSISDBHSA-N |