2-(3,4-dimethylphenyl)-5-[(2-fluoroanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-5-[(2-fluoroanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(3,4-dimethylphenyl)-5-[(2-fluoroanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D489-0179 |
| Compound Name: | 2-(3,4-dimethylphenyl)-5-[(2-fluoroanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C20 H18 F N5 O |
| Smiles: | Cc1ccc(cc1C)c1nc2NC(CNc3ccccc3F)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2863 |
| logD: | 4.0833 |
| logSw: | -4.3195 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.877 |
| InChI Key: | MZBVUNYERDPKTM-UHFFFAOYSA-N |