N-{[3-(1-methyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide
Chemical Structure Depiction of
N-{[3-(1-methyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide
N-{[3-(1-methyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide
Compound characteristics
Compound ID: | F542-0039 |
Compound Name: | N-{[3-(1-methyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide |
Molecular Weight: | 413.41 |
Molecular Formula: | C18 H15 N5 O5 S |
Smiles: | CN1C(C(Nc2cc(ccc12)c1nc(CNS(c2ccccc2)(=O)=O)on1)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.9516 |
logD: | 1.8796 |
logSw: | -2.9243 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 113.437 |
InChI Key: | GLTNWLXGYJKVHT-UHFFFAOYSA-N |