3-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
3-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzene-1-sulfonamide
3-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5591-1953 |
| Compound Name: | 3-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzene-1-sulfonamide |
| Molecular Weight: | 402.4 |
| Molecular Formula: | C17 H10 N2 O6 S2 |
| Smiles: | c1ccc2c3c(cc(c2c1)NS(c1cccc(c1)[N+]([O-])=O)(=O)=O)SC(=O)O3 |
| Stereo: | ACHIRAL |
| logP: | 3.7654 |
| logD: | 2.6476 |
| logSw: | -4.2934 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.057 |
| InChI Key: | OLDWTWXAOQXJAS-UHFFFAOYSA-N |