N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | L310-2509 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 486.5 |
| Molecular Formula: | C22 H22 N4 O7 S |
| Smiles: | CCc1nc(CN2C(COc3cc(c(C)cc23)S(Nc2ccc3c(c2)OCCO3)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 1.8862 |
| logD: | 1.819 |
| logSw: | -2.7823 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.146 |
| InChI Key: | AEQOOGAQADCKKL-UHFFFAOYSA-N |