1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methylbutan-1-one
Chemical Structure Depiction of
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methylbutan-1-one
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methylbutan-1-one
Compound characteristics
Compound ID: | 8014-0456 |
Compound Name: | 1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methylbutan-1-one |
Molecular Weight: | 325.79 |
Molecular Formula: | C15 H20 Cl N3 O3 |
Smiles: | CC(C)CC(N1CCN(CC1)c1ccc(cc1[Cl])[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4167 |
logD: | 3.4167 |
logSw: | -3.7571 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 52.972 |
InChI Key: | UWZNZESRCZDAID-UHFFFAOYSA-N |