2-(4-fluoroanilino)-8-methyl-4-(thiophen-2-yl)-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Chemical Structure Depiction of
2-(4-fluoroanilino)-8-methyl-4-(thiophen-2-yl)-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
2-(4-fluoroanilino)-8-methyl-4-(thiophen-2-yl)-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Compound characteristics
| Compound ID: | 8561-08509 |
| Compound Name: | 2-(4-fluoroanilino)-8-methyl-4-(thiophen-2-yl)-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C17 H14 F N5 O S |
| Smiles: | CC1=CC(N2C(c3cccs3)N=C(NC2=N1)Nc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8098 |
| logD: | -0.1124 |
| logSw: | -3.3805 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.489 |
| InChI Key: | TXIYRCMSMANXJJ-OAHLLOKOSA-N |