N-[7-(2-chlorophenyl)-5-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-methylbenzamide
Chemical Structure Depiction of
N-[7-(2-chlorophenyl)-5-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-methylbenzamide
N-[7-(2-chlorophenyl)-5-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-methylbenzamide
Compound characteristics
| Compound ID: | D481-0669 |
| Compound Name: | N-[7-(2-chlorophenyl)-5-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-methylbenzamide |
| Molecular Weight: | 512.83 |
| Molecular Formula: | C25 H19 Cl2 N5 O |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1)C(Nc1nc2NC(=CC(c3ccccc3[Cl])n2n1)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5533 |
| logD: | 6.4649 |
| logSw: | -6.2182 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.884 |
| InChI Key: | KZERQLHVDOLVPV-QFIPXVFZSA-N |