1-benzyl-4-(1,1-dichloro-3-{1-[(6-chloropyridin-3-yl)methyl]imidazolidin-2-ylidene}-3-nitroprop-1-en-2-yl)piperazine
Chemical Structure Depiction of
1-benzyl-4-(1,1-dichloro-3-{1-[(6-chloropyridin-3-yl)methyl]imidazolidin-2-ylidene}-3-nitroprop-1-en-2-yl)piperazine
1-benzyl-4-(1,1-dichloro-3-{1-[(6-chloropyridin-3-yl)methyl]imidazolidin-2-ylidene}-3-nitroprop-1-en-2-yl)piperazine
Compound characteristics
Compound ID: | 4872-0706 |
Compound Name: | 1-benzyl-4-(1,1-dichloro-3-{1-[(6-chloropyridin-3-yl)methyl]imidazolidin-2-ylidene}-3-nitroprop-1-en-2-yl)piperazine |
Molecular Weight: | 523.85 |
Molecular Formula: | C23 H25 Cl3 N6 O2 |
Smiles: | C1CN(Cc2ccc(nc2)[Cl])C(=C(/C(=C([Cl])[Cl])N2CCN(CC2)Cc2ccccc2)[N+]([O-])=O)\N1 |
Stereo: | ACHIRAL |
logP: | 3.9415 |
logD: | 3.9411 |
logSw: | -4.1796 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.794 |
InChI Key: | JHZJMYSLALDGHT-UHFFFAOYSA-N |