4-chloro-N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-chloro-N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide--hydrogen chloride (1/1)
4-chloro-N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D413-0232 |
| Compound Name: | 4-chloro-N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 516.79 |
| Molecular Formula: | C24 H16 Cl2 F N5 O |
| Salt: | HCl |
| Smiles: | C1C(c2ccc(cc2)F)n2c(NC=1c1ccc(cc1)[Cl])nc(NC(c1ccc(cc1)[Cl])=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2662 |
| logD: | 6.0706 |
| logSw: | -6.5999 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.884 |
| InChI Key: | ZQAZWDWWNYIKOR-NRFANRHFSA-N |