1-{4-[4-fluoro-2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-fluoro-2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}ethan-1-one
1-{4-[4-fluoro-2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
Compound ID: | 8012-0590 |
Compound Name: | 1-{4-[4-fluoro-2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}ethan-1-one |
Molecular Weight: | 336.36 |
Molecular Formula: | C16 H21 F N4 O3 |
Smiles: | CC(N1CCN(CC1)c1cc(c(cc1[N+]([O-])=O)F)N1CCCC1)=O |
Stereo: | ACHIRAL |
logP: | 2.2967 |
logD: | 2.2967 |
logSw: | -2.349 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 57.184 |
InChI Key: | JINNWFWPDYOYLT-UHFFFAOYSA-N |