2-(2,4-dichlorophenyl)-4-{[4-(octyloxy)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2,4-dichlorophenyl)-4-{[4-(octyloxy)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(2,4-dichlorophenyl)-4-{[4-(octyloxy)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
Compound ID: | K075-5882 |
Compound Name: | 2-(2,4-dichlorophenyl)-4-{[4-(octyloxy)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
Molecular Weight: | 446.37 |
Molecular Formula: | C24 H25 Cl2 N O3 |
Smiles: | CCCCCCCCOc1ccc(/C=C2/C(=O)OC(c3ccc(cc3[Cl])[Cl])=N2)cc1 |
Stereo: | ACHIRAL |
logP: | 7.9016 |
logD: | 7.9016 |
logSw: | -6.6174 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 37.793 |
InChI Key: | JDEQYODCVVCOEX-UHFFFAOYSA-N |