2-(3-methoxyphenyl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(3-methoxyphenyl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
Compound ID: | K074-4218 |
Compound Name: | 2-(3-methoxyphenyl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
Molecular Weight: | 321.37 |
Molecular Formula: | C20 H19 N O3 |
Smiles: | CC(C)c1ccc(/C=C2/C(=O)OC(c3cccc(c3)OC)=N2)cc1 |
Stereo: | ACHIRAL |
logP: | 4.6725 |
logD: | 4.6725 |
logSw: | -4.5809 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 37.919 |
InChI Key: | KAIWHTDWBBWRGO-UHFFFAOYSA-N |