1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-2-phenylethan-1-one
Chemical Structure Depiction of
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-2-phenylethan-1-one
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-2-phenylethan-1-one
Compound characteristics
Compound ID: | 3800-0103 |
Compound Name: | 1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-2-phenylethan-1-one |
Molecular Weight: | 359.81 |
Molecular Formula: | C18 H18 Cl N3 O3 |
Smiles: | C(C(N1CCN(CC1)c1ccc(cc1[Cl])[N+]([O-])=O)=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.735 |
logD: | 3.735 |
logSw: | -4.1352 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 52.7 |
InChI Key: | VXQCLQGBJAQKLJ-UHFFFAOYSA-N |