4-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-2-(3-methylphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-2-(3-methylphenyl)-1,3-oxazol-5(4H)-one
4-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-2-(3-methylphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2062-0303 |
| Compound Name: | 4-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-2-(3-methylphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 341.75 |
| Molecular Formula: | C18 H12 Cl N O4 |
| Smiles: | Cc1cccc(c1)C1=NC(=C/c2cc3c(cc2[Cl])OCO3)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.0606 |
| logD: | 4.0606 |
| logSw: | -4.4298 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.491 |
| InChI Key: | XJZSTIUSFXSPMC-UHFFFAOYSA-N |