2-{[(4-ethoxyphenyl)methyl]amino}-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-ethoxyphenyl)methyl]amino}-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-ethoxyphenyl)methyl]amino}-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D043-0138 |
| Compound Name: | 2-{[(4-ethoxyphenyl)methyl]amino}-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 361.4 |
| Molecular Formula: | C20 H19 N5 O2 |
| Smiles: | CCOc1ccc(CNc2nc3NC(=CC(n3n2)=O)c2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1893 |
| logD: | 2.6524 |
| logSw: | -3.3887 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.727 |
| InChI Key: | MSKZTCLKGXHJHO-UHFFFAOYSA-N |