6-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-methyl-2-phenyl-4-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
6-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-methyl-2-phenyl-4-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
6-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-methyl-2-phenyl-4-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D584-0157 |
| Compound Name: | 6-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-methyl-2-phenyl-4-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 486.55 |
| Molecular Formula: | C27 H27 F N6 O2 |
| Smiles: | [H]C([H])(C=C)N1C(C)=C(CC(N2CCN(CC2)c2ccc(cc2)F)=O)C(n2c1nc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9321 |
| logD: | 3.9321 |
| logSw: | -3.9536 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.114 |
| InChI Key: | DSGWLMVFIQFOPG-UHFFFAOYSA-N |