1-[5-(4-chlorophenyl)-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-chlorophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione
1-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | D413-0093 |
| Compound Name: | 1-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione |
| Molecular Weight: | 435.87 |
| Molecular Formula: | C22 H18 Cl N5 O3 |
| Smiles: | COc1ccc(cc1)C1C=C(c2ccc(cc2)[Cl])Nc2nc(nn12)N1C(CCC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1033 |
| logD: | 3.101 |
| logSw: | -3.9173 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.598 |
| InChI Key: | GQTYNSLTQMNCRB-GOSISDBHSA-N |