2-(4-fluorophenyl)-5-[(4-methylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(4-fluorophenyl)-5-[(4-methylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(4-fluorophenyl)-5-[(4-methylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D489-0116 |
| Compound Name: | 2-(4-fluorophenyl)-5-[(4-methylanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 349.37 |
| Molecular Formula: | C19 H16 F N5 O |
| Smiles: | Cc1ccc(cc1)NCC1=CC(n2c(N1)nc(c1ccc(cc1)F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7225 |
| logD: | 3.5188 |
| logSw: | -4.1206 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.575 |
| InChI Key: | QEHQCQKOTBOVMV-UHFFFAOYSA-N |