2-(3,5-dinitrophenyl)-4-[(4-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3,5-dinitrophenyl)-4-[(4-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(3,5-dinitrophenyl)-4-[(4-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8007-6296 |
| Compound Name: | 2-(3,5-dinitrophenyl)-4-[(4-iodophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 465.16 |
| Molecular Formula: | C16 H8 I N3 O6 |
| Smiles: | C(=C1/C(=O)OC(c2cc(cc(c2)[N+]([O-])=O)[N+]([O-])=O)=N1)\c1ccc(cc1)I |
| Stereo: | ACHIRAL |
| logP: | 4.3243 |
| logD: | 4.3243 |
| logSw: | -4.5591 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 97.139 |
| InChI Key: | XXCIKIVOWNCWHF-UHFFFAOYSA-N |