4-({4-[(2-acetamido-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]-2-chloro-6-methoxyphenoxy}methyl)benzoic acid
Chemical Structure Depiction of
4-({4-[(2-acetamido-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]-2-chloro-6-methoxyphenoxy}methyl)benzoic acid
4-({4-[(2-acetamido-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]-2-chloro-6-methoxyphenoxy}methyl)benzoic acid
Compound characteristics
| Compound ID: | 5788-2958 |
| Compound Name: | 4-({4-[(2-acetamido-4-oxo-1,3-thiazol-5(4H)-ylidene)methyl]-2-chloro-6-methoxyphenoxy}methyl)benzoic acid |
| Molecular Weight: | 460.89 |
| Molecular Formula: | C21 H17 Cl N2 O6 S |
| Smiles: | CC(NC1=NC(/C(=C\c2cc(c(c(c2)[Cl])OCc2ccc(cc2)C(O)=O)OC)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5157 |
| logD: | 0.5442 |
| logSw: | -4.0533 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.413 |
| InChI Key: | YSNLOZCEXXRGNC-UHFFFAOYSA-N |