4-({3-[(2,5-dimethoxyphenyl)carbamoyl]-8-ethoxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
Chemical Structure Depiction of
4-({3-[(2,5-dimethoxyphenyl)carbamoyl]-8-ethoxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
4-({3-[(2,5-dimethoxyphenyl)carbamoyl]-8-ethoxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
Compound characteristics
| Compound ID: | K220-43271 |
| Compound Name: | 4-({3-[(2,5-dimethoxyphenyl)carbamoyl]-8-ethoxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid |
| Molecular Weight: | 488.5 |
| Molecular Formula: | C27 H24 N2 O7 |
| Smiles: | CCOc1cccc2C=C(/C(=N/c3ccc(cc3)C(O)=O)Oc12)C(Nc1cc(ccc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5673 |
| logD: | 1.1772 |
| logSw: | -4.4506 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.815 |
| InChI Key: | MLIUWOMIRKFZCE-UHFFFAOYSA-N |