N-[7-(4-chlorophenyl)-5-(4-methylphenyl)-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-(4-chlorophenyl)-5-(4-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-fluorobenzamide--hydrogen chloride (1/1)
N-[7-(4-chlorophenyl)-5-(4-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-fluorobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D481-0495 |
| Compound Name: | N-[7-(4-chlorophenyl)-5-(4-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-fluorobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 496.37 |
| Molecular Formula: | C25 H19 Cl F N5 O |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1)C1=CC(c2ccc(cc2)[Cl])n2c(N1)nc(NC(c1ccccc1F)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0487 |
| logD: | 5.8531 |
| logSw: | -6.218 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.884 |
| InChI Key: | SIPPVPZMRNNMNY-QFIPXVFZSA-N |