N-[7-(2-chlorophenyl)-5-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-fluorobenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[7-(2-chlorophenyl)-5-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-fluorobenzamide--hydrogen chloride (1/1)
N-[7-(2-chlorophenyl)-5-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-fluorobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D481-0665 |
| Compound Name: | N-[7-(2-chlorophenyl)-5-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-fluorobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 516.79 |
| Molecular Formula: | C24 H16 Cl2 F N5 O |
| Salt: | HCl |
| Smiles: | C1C(c2ccccc2[Cl])n2c(NC=1c1ccc(cc1)[Cl])nc(NC(c1ccccc1F)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1652 |
| logD: | 5.9696 |
| logSw: | -6.034 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.884 |
| InChI Key: | VYIMREGUUUESIG-NRFANRHFSA-N |