4-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 3-nitrobenzoate
Chemical Structure Depiction of
4-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 3-nitrobenzoate
4-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 3-nitrobenzoate
Compound characteristics
| Compound ID: | 3268-0030 |
| Compound Name: | 4-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 3-nitrobenzoate |
| Molecular Weight: | 414.37 |
| Molecular Formula: | C23 H14 N2 O6 |
| Smiles: | C(=C1/C(=O)OC(c2ccccc2)=N1)\c1ccc(cc1)OC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1179 |
| logD: | 4.1179 |
| logSw: | -4.5829 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.135 |
| InChI Key: | LMHIEKWFWYWMKT-UHFFFAOYSA-N |