4-[(2,4-dichlorophenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2,4-dichlorophenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one
4-[(2,4-dichlorophenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1536 |
| Compound Name: | 4-[(2,4-dichlorophenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 377.18 |
| Molecular Formula: | C17 H10 Cl2 N2 O4 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C1=NC(=C\c2ccc(cc2[Cl])[Cl])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.8708 |
| logD: | 4.8708 |
| logSw: | -4.9665 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.456 |
| InChI Key: | TVRMSNTZCZQCEZ-UHFFFAOYSA-N |