4-[(3,4-dihydroxyphenyl)methylidene]-3-methyl-1,2-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3,4-dihydroxyphenyl)methylidene]-3-methyl-1,2-oxazol-5(4H)-one
4-[(3,4-dihydroxyphenyl)methylidene]-3-methyl-1,2-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 4338-1056 |
| Compound Name: | 4-[(3,4-dihydroxyphenyl)methylidene]-3-methyl-1,2-oxazol-5(4H)-one |
| Molecular Weight: | 219.19 |
| Molecular Formula: | C11 H9 N O4 |
| Smiles: | CC1/C(=C/c2ccc(c(c2)O)O)C(=O)ON=1 |
| Stereo: | ACHIRAL |
| logP: | 0.9013 |
| logD: | 0.8962 |
| logSw: | -1.3996 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.232 |
| InChI Key: | AJUHPFBSVRBMSK-UHFFFAOYSA-N |