sodium--[2-(4-{(2,5-dimethylbenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}phenyl)acetamido]oxidanide (1/1)
Chemical Structure Depiction of
sodium--[2-(4-{(2,5-dimethylbenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}phenyl)acetamido]oxidanide (1/1)
sodium--[2-(4-{(2,5-dimethylbenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}phenyl)acetamido]oxidanide (1/1)
Compound characteristics
| Compound ID: | K783-3189 |
| Compound Name: | sodium--[2-(4-{(2,5-dimethylbenzene-1-sulfonyl)[(4-fluorophenyl)methyl]amino}phenyl)acetamido]oxidanide (1/1) |
| Molecular Weight: | 464.49 |
| Molecular Formula: | C23 H22 F N2 O4 S |
| Salt: | Na+ |
| Smiles: | Cc1ccc(C)c(c1)S(N(Cc1ccc(cc1)F)c1ccc(CC(N[O-])=O)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5132 |
| logD: | 3.5132 |
| logSw: | -3.6897 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.504 |
| InChI Key: | RIRXITHOJSTCQU-UHFFFAOYSA-N |