4-benzylidene-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-benzylidene-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
4-benzylidene-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1021 |
| Compound Name: | 4-benzylidene-2-[2-(3-nitrophenyl)ethenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 320.3 |
| Molecular Formula: | C18 H12 N2 O4 |
| Smiles: | C(=C\c1cccc(c1)[N+]([O-])=O)\C1=NC(=C\c2ccccc2)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.8934 |
| logD: | 3.8934 |
| logSw: | -4.2385 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.903 |
| InChI Key: | MQXMBODJJKNZTP-UHFFFAOYSA-N |