4-{[4-(methylsulfanyl)phenyl]methylidene}-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-{[4-(methylsulfanyl)phenyl]methylidene}-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-{[4-(methylsulfanyl)phenyl]methylidene}-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K074-0942 |
| Compound Name: | 4-{[4-(methylsulfanyl)phenyl]methylidene}-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 385.44 |
| Molecular Formula: | C20 H19 N O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)C1=NC(=C/c2ccc(cc2)SC)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.6492 |
| logD: | 3.6492 |
| logSw: | -4.0997 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.354 |
| InChI Key: | JHAIGVCZOSORTP-UHFFFAOYSA-N |