3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,6-dimethylpyridin-2(1H)-one
Chemical Structure Depiction of
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,6-dimethylpyridin-2(1H)-one
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,6-dimethylpyridin-2(1H)-one
Compound characteristics
Compound ID: | C200-7154 |
Compound Name: | 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,6-dimethylpyridin-2(1H)-one |
Molecular Weight: | 521.98 |
Molecular Formula: | C27 H25 Cl F N5 O3 |
Smiles: | CC1=CC(C)=C(C(N1CC(N1CCN(CC1)c1ccc(cc1)F)=O)=O)c1nc(c2ccc(cc2)[Cl])no1 |
Stereo: | ACHIRAL |
logP: | 4.6919 |
logD: | 4.6919 |
logSw: | -4.8381 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 66.485 |
InChI Key: | PQKPBTSPCMNTAH-UHFFFAOYSA-N |