N-{[3-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide
Chemical Structure Depiction of
N-{[3-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide
N-{[3-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide
Compound characteristics
| Compound ID: | L834-1080 |
| Compound Name: | N-{[3-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide |
| Molecular Weight: | 428.47 |
| Molecular Formula: | C20 H20 N4 O5 S |
| Smiles: | CCCN1C(COc2ccc(cc12)c1nc(CNS(c2ccccc2)(=O)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9644 |
| logD: | 2.8924 |
| logSw: | -3.592 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.42 |
| InChI Key: | AVLKLYRJBAOFQD-UHFFFAOYSA-N |