5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(1-phenylethyl)aniline
Chemical Structure Depiction of
5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(1-phenylethyl)aniline
5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(1-phenylethyl)aniline
Compound characteristics
Compound ID: | 8012-1138 |
Compound Name: | 5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitro-N-(1-phenylethyl)aniline |
Molecular Weight: | 466.56 |
Molecular Formula: | C24 H26 N4 O4 S |
Smiles: | CC(c1ccccc1)Nc1cc(ccc1[N+]([O-])=O)N1CCN(CC1)S(c1ccccc1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.4172 |
logD: | 4.4172 |
logSw: | -4.2949 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.99 |
InChI Key: | QTGRSDWBYMNKTP-IBGZPJMESA-N |