sodium--N~3~-benzyl-N~3~-(4-fluorobenzene-1-sulfonyl)-N-oxido-beta-alaninamide (1/1)
Chemical Structure Depiction of
sodium--N~3~-benzyl-N~3~-(4-fluorobenzene-1-sulfonyl)-N-oxido-beta-alaninamide (1/1)
sodium--N~3~-benzyl-N~3~-(4-fluorobenzene-1-sulfonyl)-N-oxido-beta-alaninamide (1/1)
Compound characteristics
| Compound ID: | K783-1578 |
| Compound Name: | sodium--N~3~-benzyl-N~3~-(4-fluorobenzene-1-sulfonyl)-N-oxido-beta-alaninamide (1/1) |
| Molecular Weight: | 374.36 |
| Molecular Formula: | C16 H16 F N2 O4 S |
| Salt: | Na+ |
| Smiles: | C(CN(Cc1ccccc1)S(c1ccc(cc1)F)(=O)=O)C(N[O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6782 |
| logD: | 1.6782 |
| logSw: | -2.4684 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.304 |
| InChI Key: | OTKZGUJREDNGCB-UHFFFAOYSA-N |