2-(4-fluorophenyl)-5-[(3-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(4-fluorophenyl)-5-[(3-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(4-fluorophenyl)-5-[(3-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D489-0111 |
| Compound Name: | 2-(4-fluorophenyl)-5-[(3-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 365.37 |
| Molecular Formula: | C19 H16 F N5 O2 |
| Smiles: | COc1cccc(c1)NCC1=CC(n2c(N1)nc(c1ccc(cc1)F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2379 |
| logD: | 3.0348 |
| logSw: | -3.5424 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.119 |
| InChI Key: | KTEDWTMMWOAKOA-UHFFFAOYSA-N |