3-{3-[(2,5-dimethylfuran-3-carbonyl)amino]phenyl}prop-2-enoic acid
Chemical Structure Depiction of
3-{3-[(2,5-dimethylfuran-3-carbonyl)amino]phenyl}prop-2-enoic acid
3-{3-[(2,5-dimethylfuran-3-carbonyl)amino]phenyl}prop-2-enoic acid
Compound characteristics
| Compound ID: | 8009-6576 |
| Compound Name: | 3-{3-[(2,5-dimethylfuran-3-carbonyl)amino]phenyl}prop-2-enoic acid |
| Molecular Weight: | 285.3 |
| Molecular Formula: | C16 H15 N O4 |
| Smiles: | Cc1cc(C(Nc2cccc(/C=C/C(O)=O)c2)=O)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.1336 |
| logD: | -0.057 |
| logSw: | -3.3382 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.46 |
| InChI Key: | LEBFXWUDMPQXCH-UHFFFAOYSA-N |