3-(3-nitrophenyl)-3-[(phenylmethanesulfonyl)amino]propanoic acid
Chemical Structure Depiction of
3-(3-nitrophenyl)-3-[(phenylmethanesulfonyl)amino]propanoic acid
3-(3-nitrophenyl)-3-[(phenylmethanesulfonyl)amino]propanoic acid
Compound characteristics
| Compound ID: | 8013-4100 |
| Compound Name: | 3-(3-nitrophenyl)-3-[(phenylmethanesulfonyl)amino]propanoic acid |
| Molecular Weight: | 364.37 |
| Molecular Formula: | C16 H16 N2 O6 S |
| Smiles: | C(C(c1cccc(c1)[N+]([O-])=O)NS(Cc1ccccc1)(=O)=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8377 |
| logD: | -0.9633 |
| logSw: | -2.5519 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.233 |
| InChI Key: | VLQJDYZLSCDHME-HNNXBMFYSA-N |