2-{[(4-fluorophenyl)methyl]amino}-5-[(2-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]amino}-5-[(2-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-fluorophenyl)methyl]amino}-5-[(2-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0277 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]amino}-5-[(2-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 394.41 |
| Molecular Formula: | C20 H19 F N6 O2 |
| Smiles: | COc1ccccc1NCC1=CC(n2c(N1)nc(NCc1ccc(cc1)F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5587 |
| logD: | 2.2725 |
| logSw: | -2.9446 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.148 |
| InChI Key: | DAXILCARJBCTBL-UHFFFAOYSA-N |