5,5,5-trifluoro-4-{[(4-nitrobenzene-1-sulfonyl)amino]methyl}pentanoic acid
Chemical Structure Depiction of
5,5,5-trifluoro-4-{[(4-nitrobenzene-1-sulfonyl)amino]methyl}pentanoic acid
5,5,5-trifluoro-4-{[(4-nitrobenzene-1-sulfonyl)amino]methyl}pentanoic acid
Compound characteristics
| Compound ID: | 2294-0318 |
| Compound Name: | 5,5,5-trifluoro-4-{[(4-nitrobenzene-1-sulfonyl)amino]methyl}pentanoic acid |
| Molecular Weight: | 370.3 |
| Molecular Formula: | C12 H13 F3 N2 O6 S |
| Smiles: | C(CC(O)=O)C(CNS(c1ccc(cc1)[N+]([O-])=O)(=O)=O)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9397 |
| logD: | -0.8885 |
| logSw: | -2.6859 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.034 |
| InChI Key: | NSEGVQVTJRXODS-QMMMGPOBSA-N |