1-(4-bromobenzene-1-sulfonyl)-4-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-4-nitrophenyl}piperazine
Chemical Structure Depiction of
1-(4-bromobenzene-1-sulfonyl)-4-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-4-nitrophenyl}piperazine
1-(4-bromobenzene-1-sulfonyl)-4-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-4-nitrophenyl}piperazine
Compound characteristics
Compound ID: | 8014-0466 |
Compound Name: | 1-(4-bromobenzene-1-sulfonyl)-4-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-4-nitrophenyl}piperazine |
Molecular Weight: | 616.53 |
Molecular Formula: | C27 H30 Br N5 O5 S |
Smiles: | COc1ccccc1N1CCN(CC1)c1cc(ccc1[N+]([O-])=O)N1CCN(CC1)S(c1ccc(cc1)[Br])(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.4116 |
logD: | 5.4116 |
logSw: | -5.4256 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 82.032 |
InChI Key: | PKOCYPCMVRVOHQ-UHFFFAOYSA-N |