1-(4-{[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazin-1-yl)-3,3,3-trifluoropropan-1-one
Chemical Structure Depiction of
1-(4-{[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazin-1-yl)-3,3,3-trifluoropropan-1-one
1-(4-{[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazin-1-yl)-3,3,3-trifluoropropan-1-one
Compound characteristics
Compound ID: | D676-5045 |
Compound Name: | 1-(4-{[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazin-1-yl)-3,3,3-trifluoropropan-1-one |
Molecular Weight: | 388.77 |
Molecular Formula: | C16 H16 Cl F3 N4 O2 |
Smiles: | C(C(N1CCN(CC1)Cc1nc(c2cccc(c2)[Cl])on1)=O)C(F)(F)F |
Stereo: | ACHIRAL |
logP: | 2.5583 |
logD: | 2.5583 |
logSw: | -3.2263 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 52.839 |
InChI Key: | BONJJWWEFKWTHQ-UHFFFAOYSA-N |