4-(4-ethoxyanilino)-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-(4-ethoxyanilino)-4-oxobut-2-enoic acid
4-(4-ethoxyanilino)-4-oxobut-2-enoic acid
Compound characteristics
| Compound ID: | C429-0631 |
| Compound Name: | 4-(4-ethoxyanilino)-4-oxobut-2-enoic acid |
| Molecular Weight: | 235.24 |
| Molecular Formula: | C12 H13 N O4 |
| Smiles: | CCOc1ccc(cc1)NC(/C=C/C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.903 |
| logD: | -2.5554 |
| logSw: | -2.466 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.895 |
| InChI Key: | LMTIUWRMRAZPEN-UHFFFAOYSA-N |