4-(2-iodoanilino)-4-oxo-3-(oxolan-2-yl)butanoic acid
Chemical Structure Depiction of
4-(2-iodoanilino)-4-oxo-3-(oxolan-2-yl)butanoic acid
4-(2-iodoanilino)-4-oxo-3-(oxolan-2-yl)butanoic acid
Compound characteristics
| Compound ID: | 4333-1365 |
| Compound Name: | 4-(2-iodoanilino)-4-oxo-3-(oxolan-2-yl)butanoic acid |
| Molecular Weight: | 389.19 |
| Molecular Formula: | C14 H16 I N O4 |
| Smiles: | C1CC(C(CC(O)=O)C(Nc2ccccc2I)=O)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6221 |
| logD: | -1.1226 |
| logSw: | -2.238 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.428 |
| InChI Key: | DIBRTHHIQBAKPJ-UHFFFAOYSA-N |