4-fluoro-N-({3-[1-(2-methylpropyl)-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl]-1,2,4-oxadiazol-5-yl}methyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-fluoro-N-({3-[1-(2-methylpropyl)-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl]-1,2,4-oxadiazol-5-yl}methyl)benzene-1-sulfonamide
4-fluoro-N-({3-[1-(2-methylpropyl)-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl]-1,2,4-oxadiazol-5-yl}methyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | F542-0745 |
| Compound Name: | 4-fluoro-N-({3-[1-(2-methylpropyl)-2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl]-1,2,4-oxadiazol-5-yl}methyl)benzene-1-sulfonamide |
| Molecular Weight: | 473.48 |
| Molecular Formula: | C21 H20 F N5 O5 S |
| Smiles: | CC(C)CN1C(C(Nc2cc(ccc12)c1nc(CNS(c2ccc(cc2)F)(=O)=O)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7007 |
| logD: | 3.6287 |
| logSw: | -4.1158 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.671 |
| InChI Key: | SSFOSCAFSWCGKX-UHFFFAOYSA-N |