N-[7-(2-chloro-6-fluorophenyl)-5-(4-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methoxybenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[7-(2-chloro-6-fluorophenyl)-5-(4-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methoxybenzamide--hydrogen chloride (1/1)
N-[7-(2-chloro-6-fluorophenyl)-5-(4-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methoxybenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D481-0797 |
| Compound Name: | N-[7-(2-chloro-6-fluorophenyl)-5-(4-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methoxybenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 526.4 |
| Molecular Formula: | C26 H21 Cl F N5 O2 |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1)C1=CC(c2c(cccc2[Cl])F)n2c(N1)nc(NC(c1ccc(cc1)OC)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7935 |
| logD: | 5.7797 |
| logSw: | -6.0565 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.428 |
| InChI Key: | SKWFKZLNMADREB-QFIPXVFZSA-N |