3-chloro-N-[5-(4-methylphenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-chloro-N-[5-(4-methylphenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide--hydrogen chloride (1/1)
3-chloro-N-[5-(4-methylphenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D481-0296 |
| Compound Name: | 3-chloro-N-[5-(4-methylphenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 478.38 |
| Molecular Formula: | C25 H20 Cl N5 O |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1)C1=CC(c2ccccc2)n2c(N1)nc(NC(c1cccc(c1)[Cl])=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1382 |
| logD: | 5.957 |
| logSw: | -6.1629 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.884 |
| InChI Key: | DHIJRTYOERLCFW-QFIPXVFZSA-N |