7-(3-fluoro-4-methylanilino)-5-methyl-2-[(oxolan-2-yl)methyl][1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
Chemical Structure Depiction of
7-(3-fluoro-4-methylanilino)-5-methyl-2-[(oxolan-2-yl)methyl][1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
7-(3-fluoro-4-methylanilino)-5-methyl-2-[(oxolan-2-yl)methyl][1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
Compound characteristics
| Compound ID: | P573-7882 |
| Compound Name: | 7-(3-fluoro-4-methylanilino)-5-methyl-2-[(oxolan-2-yl)methyl][1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one |
| Molecular Weight: | 357.39 |
| Molecular Formula: | C18 H20 F N5 O2 |
| Smiles: | CC1=CC(Nc2ccc(C)c(c2)F)=NC2=NN(CC3CCCO3)C(N12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6398 |
| logD: | 2.6371 |
| logSw: | -2.9436 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.164 |
| InChI Key: | CXDFCAYPGMXDGG-CQSZACIVSA-N |