N-(benzenesulfonyl)-beta-alanine
Chemical Structure Depiction of
N-(benzenesulfonyl)-beta-alanine
N-(benzenesulfonyl)-beta-alanine
Compound characteristics
| Compound ID: | Y041-3053 |
| Compound Name: | N-(benzenesulfonyl)-beta-alanine |
| Molecular Weight: | 229.25 |
| Molecular Formula: | C9 H11 N O4 S |
| Smiles: | C(CNS(c1ccccc1)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4024 |
| logD: | -2.4565 |
| logSw: | -2.0701 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.494 |
| InChI Key: | IRSJDWBJMSUIBW-UHFFFAOYSA-N |