2-cyclohexyl-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-cyclohexyl-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
2-cyclohexyl-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0105 |
| Compound Name: | 2-cyclohexyl-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 300.31 |
| Molecular Formula: | C16 H16 N2 O4 |
| Smiles: | C1CCC(CC1)C1=NC(=C/c2cccc(c2)[N+]([O-])=O)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.6545 |
| logD: | 3.6545 |
| logSw: | -3.9455 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.949 |
| InChI Key: | XKFXNDQSHCQRKK-UHFFFAOYSA-N |