5-[(5-chloro-2-methoxyanilino)methyl]-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-[(5-chloro-2-methoxyanilino)methyl]-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-[(5-chloro-2-methoxyanilino)methyl]-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0407 |
| Compound Name: | 5-[(5-chloro-2-methoxyanilino)methyl]-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 395.85 |
| Molecular Formula: | C20 H18 Cl N5 O2 |
| Smiles: | Cc1ccccc1c1nc2NC(CNc3cc(ccc3OC)[Cl])=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.839 |
| logD: | 3.7922 |
| logSw: | -4.3146 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.508 |
| InChI Key: | WOTOVCDQAZXKCQ-UHFFFAOYSA-N |