N-{2-[3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide
N-{2-[3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L834-0561 |
| Compound Name: | N-{2-[3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C21 H22 N4 O5 S |
| Smiles: | CCN1C(COc2ccc(cc12)c1nc(CCNS(c2ccc(C)cc2)(=O)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4019 |
| logD: | 3.4016 |
| logSw: | -3.983 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.007 |
| InChI Key: | URSYOGGQQCIPBI-UHFFFAOYSA-N |