4-ethyl-6-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
4-ethyl-6-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
4-ethyl-6-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D527-0158 |
| Compound Name: | 4-ethyl-6-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 500.6 |
| Molecular Formula: | C28 H32 N6 O3 |
| Smiles: | [H]C([H])([H])C([H])([H])N1C(C)=C(CCC(N2CCN(CC2)c2ccccc2OC)=O)C(n2c1nc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7011 |
| logD: | 3.7009 |
| logSw: | -3.9002 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.19 |
| InChI Key: | DYADCHYKQKLWMB-UHFFFAOYSA-N |