2-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Chemical Structure Depiction of
2-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
2-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Compound characteristics
| Compound ID: | D245-0622 |
| Compound Name: | 2-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine |
| Molecular Weight: | 393.87 |
| Molecular Formula: | C21 H20 Cl N5 O |
| Smiles: | CCOc1ccc(cc1)Nc1cc(C)nc2nc(Cc3ccc(cc3)[Cl])nn12 |
| Stereo: | ACHIRAL |
| logP: | 4.8447 |
| logD: | 4.8408 |
| logSw: | -4.7417 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.954 |
| InChI Key: | DDDGSDDJMFMHOV-UHFFFAOYSA-N |