2-methyl-5-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
2-methyl-5-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzene-1-sulfonamide
2-methyl-5-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzene-1-sulfonamide
Compound characteristics
Compound ID: | 5591-3825 |
Compound Name: | 2-methyl-5-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzene-1-sulfonamide |
Molecular Weight: | 416.43 |
Molecular Formula: | C18 H12 N2 O6 S2 |
Smiles: | Cc1ccc(cc1S(Nc1cc2c(c3ccccc13)OC(=O)S2)(=O)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.3365 |
logD: | 2.5437 |
logSw: | -4.4346 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 95.057 |
InChI Key: | CDQCTDKSRHVWHG-UHFFFAOYSA-N |