N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-4-nitrobenzene-1-sulfonamide
N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-4-nitrobenzene-1-sulfonamide
Compound characteristics
Compound ID: | C279-0883 |
Compound Name: | N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-4-nitrobenzene-1-sulfonamide |
Molecular Weight: | 401.44 |
Molecular Formula: | C19 H19 N3 O5 S |
Smiles: | Cc1ccc(C)c2c1C=C(CCNS(c1ccc(cc1)[N+]([O-])=O)(=O)=O)C(N2)=O |
Stereo: | ACHIRAL |
logP: | 3.2886 |
logD: | 3.2882 |
logSw: | -3.7551 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 97.845 |
InChI Key: | NOBKWRPWBOPGHH-UHFFFAOYSA-N |