N-[(2-chlorophenyl)methyl]-7-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyrimidin-5-amine
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-7-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyrimidin-5-amine
N-[(2-chlorophenyl)methyl]-7-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyrimidin-5-amine
Compound characteristics
| Compound ID: | D150-0258 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-7-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyrimidin-5-amine |
| Molecular Weight: | 365.82 |
| Molecular Formula: | C19 H16 Cl N5 O |
| Smiles: | COc1ccc(cc1)c1cc(NCc2ccccc2[Cl])n2cnnc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.013 |
| logD: | 4.009 |
| logSw: | -4.4914 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.019 |
| InChI Key: | HDIWXKQYMLZTPP-UHFFFAOYSA-N |