1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(4-nitrophenyl)piperazine
Chemical Structure Depiction of
1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(4-nitrophenyl)piperazine
1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(4-nitrophenyl)piperazine
Compound characteristics
Compound ID: | C085-2308 |
Compound Name: | 1-(3,4-dimethoxybenzene-1-sulfonyl)-4-(4-nitrophenyl)piperazine |
Molecular Weight: | 407.44 |
Molecular Formula: | C18 H21 N3 O6 S |
Smiles: | COc1ccc(cc1OC)S(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6621 |
logD: | 2.6621 |
logSw: | -3.0468 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 83.852 |
InChI Key: | NTMIEVMPJOAMLP-UHFFFAOYSA-N |