2-(3,4-dichlorophenyl)-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3,4-dichlorophenyl)-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(3,4-dichlorophenyl)-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
Compound ID: | K075-2922 |
Compound Name: | 2-(3,4-dichlorophenyl)-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
Molecular Weight: | 364.25 |
Molecular Formula: | C17 H11 Cl2 N O2 S |
Smiles: | CSc1ccc(/C=C2/C(=O)OC(c3ccc(c(c3)[Cl])[Cl])=N2)cc1 |
Stereo: | ACHIRAL |
logP: | 5.2755 |
logD: | 5.2755 |
logSw: | -6.0718 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 30.3756 |
InChI Key: | PRHVMKLRNRIKIG-UHFFFAOYSA-N |