sodium--[2-(4-{[(4-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}phenyl)acetamido]oxidanide (1/1)
Chemical Structure Depiction of
sodium--[2-(4-{[(4-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}phenyl)acetamido]oxidanide (1/1)
sodium--[2-(4-{[(4-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}phenyl)acetamido]oxidanide (1/1)
Compound characteristics
| Compound ID: | K783-3201 |
| Compound Name: | sodium--[2-(4-{[(4-chlorophenyl)methyl](4-nitrobenzene-1-sulfonyl)amino}phenyl)acetamido]oxidanide (1/1) |
| Molecular Weight: | 497.89 |
| Molecular Formula: | C21 H17 Cl N3 O6 S |
| Salt: | Na+ |
| Smiles: | C(C(N[O-])=O)c1ccc(cc1)N(Cc1ccc(cc1)[Cl])S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2127 |
| logD: | 3.2127 |
| logSw: | -3.5645 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.885 |
| InChI Key: | CGXBIMOBGLEJLN-UHFFFAOYSA-N |