sodium--[4-({(4-bromobenzene-1-sulfonyl)[(2-methylphenyl)methyl]amino}methyl)benzamido]oxidanide (1/1)
Chemical Structure Depiction of
sodium--[4-({(4-bromobenzene-1-sulfonyl)[(2-methylphenyl)methyl]amino}methyl)benzamido]oxidanide (1/1)
sodium--[4-({(4-bromobenzene-1-sulfonyl)[(2-methylphenyl)methyl]amino}methyl)benzamido]oxidanide (1/1)
Compound characteristics
| Compound ID: | K783-3533 |
| Compound Name: | sodium--[4-({(4-bromobenzene-1-sulfonyl)[(2-methylphenyl)methyl]amino}methyl)benzamido]oxidanide (1/1) |
| Molecular Weight: | 511.37 |
| Molecular Formula: | C22 H20 Br N2 O4 S |
| Salt: | Na+ |
| Smiles: | Cc1ccccc1CN(Cc1ccc(cc1)C(N[O-])=O)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4648 |
| logD: | 4.4648 |
| logSw: | -4.1813 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.267 |
| InChI Key: | WYOSNKJTOXHQQT-UHFFFAOYSA-N |