1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-1-one
Chemical Structure Depiction of
1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-1-one
1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-1-one
Compound characteristics
Compound ID: | C561-1907 |
Compound Name: | 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-1-one |
Molecular Weight: | 396.47 |
Molecular Formula: | C21 H25 F N6 O |
Smiles: | Cc1c(CCC(N2CCN(CC2)c2ccc(cc2)F)=O)c(C)n2c(n1)nc(C)n2 |
Stereo: | ACHIRAL |
logP: | 1.9112 |
logD: | 1.9108 |
logSw: | -2.1866 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 50.37 |
InChI Key: | HBUNEBMNTYUUPW-UHFFFAOYSA-N |