4-[(3-methylthiophen-2-yl)methylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3-methylthiophen-2-yl)methylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-[(3-methylthiophen-2-yl)methylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K074-0861 |
| Compound Name: | 4-[(3-methylthiophen-2-yl)methylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 359.4 |
| Molecular Formula: | C18 H17 N O5 S |
| Smiles: | Cc1ccsc1/C=C1/C(=O)OC(c2cc(c(c(c2)OC)OC)OC)=N1 |
| Stereo: | ACHIRAL |
| logP: | 3.1271 |
| logD: | 3.1271 |
| logSw: | -3.3047 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.372 |
| InChI Key: | IATOWYJOPNFXCI-UHFFFAOYSA-N |