1-(4-{6-ethyl-5-[(3-fluorophenyl)methyl]-2-methylpyrimidin-4-yl}piperazin-1-yl)heptan-1-one
Chemical Structure Depiction of
1-(4-{6-ethyl-5-[(3-fluorophenyl)methyl]-2-methylpyrimidin-4-yl}piperazin-1-yl)heptan-1-one
1-(4-{6-ethyl-5-[(3-fluorophenyl)methyl]-2-methylpyrimidin-4-yl}piperazin-1-yl)heptan-1-one
Compound characteristics
Compound ID: | V008-8103 |
Compound Name: | 1-(4-{6-ethyl-5-[(3-fluorophenyl)methyl]-2-methylpyrimidin-4-yl}piperazin-1-yl)heptan-1-one |
Molecular Weight: | 426.58 |
Molecular Formula: | C25 H35 F N4 O |
Smiles: | CCCCCCC(N1CCN(CC1)c1c(Cc2cccc(c2)F)c(CC)nc(C)n1)=O |
Stereo: | ACHIRAL |
logP: | 5.8584 |
logD: | 5.7487 |
logSw: | -5.253 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 39.002 |
InChI Key: | TYYVJNDZBXKQPV-UHFFFAOYSA-N |