4-({3-[(3-chloro-4-fluorophenyl)carbamoyl]-6-methoxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
Chemical Structure Depiction of
4-({3-[(3-chloro-4-fluorophenyl)carbamoyl]-6-methoxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
4-({3-[(3-chloro-4-fluorophenyl)carbamoyl]-6-methoxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid
Compound characteristics
| Compound ID: | K220-27471 |
| Compound Name: | 4-({3-[(3-chloro-4-fluorophenyl)carbamoyl]-6-methoxy-2H-1-benzopyran-2-ylidene}amino)benzoic acid |
| Molecular Weight: | 466.85 |
| Molecular Formula: | C24 H16 Cl F N2 O5 |
| Smiles: | COc1ccc2c(C=C(/C(=N/c3ccc(cc3)C(O)=O)O2)C(Nc2ccc(c(c2)[Cl])F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.0109 |
| logD: | 1.6208 |
| logSw: | -4.9511 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.988 |
| InChI Key: | RMNIHUGDHQVWDT-UHFFFAOYSA-N |