2-(2,3-dichloroanilino)-4-(4-fluorophenyl)-8-methyl-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Chemical Structure Depiction of
2-(2,3-dichloroanilino)-4-(4-fluorophenyl)-8-methyl-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
2-(2,3-dichloroanilino)-4-(4-fluorophenyl)-8-methyl-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Compound characteristics
| Compound ID: | D718-0127 |
| Compound Name: | 2-(2,3-dichloroanilino)-4-(4-fluorophenyl)-8-methyl-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one |
| Molecular Weight: | 418.26 |
| Molecular Formula: | C19 H14 Cl2 F N5 O |
| Smiles: | CC1=CC(N2C(c3ccc(cc3)F)N=C(NC2=N1)Nc1cccc(c1[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4477 |
| logD: | 2.9263 |
| logSw: | -4.5266 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.773 |
| InChI Key: | ZRHINUYDBROOBQ-QGZVFWFLSA-N |