4-({3-[(3-chloro-4-fluorophenyl)carbamoyl]-7-hydroxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
Chemical Structure Depiction of
4-({3-[(3-chloro-4-fluorophenyl)carbamoyl]-7-hydroxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
4-({3-[(3-chloro-4-fluorophenyl)carbamoyl]-7-hydroxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
Compound characteristics
| Compound ID: | K220-18544 |
| Compound Name: | 4-({3-[(3-chloro-4-fluorophenyl)carbamoyl]-7-hydroxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid |
| Molecular Weight: | 452.82 |
| Molecular Formula: | C23 H14 Cl F N2 O5 |
| Smiles: | C1=C(/C(=N/c2ccc(cc2)C(O)=O)Oc2cc(ccc12)O)C(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5748 |
| logD: | 1.1847 |
| logSw: | -4.4454 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.061 |
| InChI Key: | FASJQPAYYMGDEG-UHFFFAOYSA-N |