N-cyclooctyl-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-cyclooctyl-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
N-cyclooctyl-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: | L310-2399 |
Compound Name: | N-cyclooctyl-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: | 462.57 |
Molecular Formula: | C22 H30 N4 O5 S |
Smiles: | CCc1nc(CN2C(COc3cc(c(C)cc23)S(NC2CCCCCCC2)(=O)=O)=O)no1 |
Stereo: | ACHIRAL |
logP: | 4.0446 |
logD: | 4.0445 |
logSw: | -4.0476 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 98.701 |
InChI Key: | UDDZIVKJIIDFEN-UHFFFAOYSA-N |