N-{2-[3-(2,3-dioxo-1-propyl-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[3-(2,3-dioxo-1-propyl-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide
N-{2-[3-(2,3-dioxo-1-propyl-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | F542-0474 |
| Compound Name: | N-{2-[3-(2,3-dioxo-1-propyl-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 469.52 |
| Molecular Formula: | C22 H23 N5 O5 S |
| Smiles: | CCCN1C(C(Nc2cc(ccc12)c1nc(CCNS(c2ccc(C)cc2)(=O)=O)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9235 |
| logD: | 3.9045 |
| logSw: | -3.9808 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.491 |
| InChI Key: | YDOXOJDWZQSRMG-UHFFFAOYSA-N |