5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-2-phenyl-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-2-phenyl-1,3-thiazol-4(5H)-one
5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-2-phenyl-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | Y500-4899 |
| Compound Name: | 5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-2-phenyl-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 345.8 |
| Molecular Formula: | C17 H12 Cl N O3 S |
| Smiles: | COc1cc(/C=C2/C(N=C(c3ccccc3)S2)=O)cc(c1O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7857 |
| logD: | 3.7128 |
| logSw: | -4.0573 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.397 |
| InChI Key: | BTIAAMWQYVYEFI-UHFFFAOYSA-N |