2,2'-(1,4-Phenylene)bis(4-((4-methoxyphenyl)methylene)-5(4H)-oxazolone)
Basic information
- CAS
51202-86-9- Standard SMILES
COc1ccc(C=C2N=C(c3ccc(C4=NC(=Cc5ccc(OC)cc5)C(=O)O4)cc3)OC2=O)cc1- InChIKey
XZRFHDOOIZDXFC-UHFFFAOYSA-N- Molecular formula
- C28H20N2O6
- Average molar mass
- 480.5 g/mol
- Monoisotopic mass
- 480.13213636
Overview
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Names & identifiers
- Preferred name
- 2,2'-(1,4-Phenylene)bis(4-((4-methoxyphenyl)methylene)-5(4H)-oxazolone)
- IUPAC
- 4-[(4-methoxyphenyl)methylidene]-2-[4-[4-[(4-methoxyphenyl)methylidene]-5-oxo-1,3-oxazol-2-yl]phenyl]-1,3-oxazol-5-one
Names & synonyms
2,2'-(1,4-Phenylene)bis[4-[(4-methoxyphenyl)methylene]-5(4H)-oxazolone]2,2'-(1,4-Phenylene)bis(4-((4-methoxyphenyl)methylene)-5(4H)-oxazolone)RefChem:44011651202-86-9R4BK39J29WDTXSID8068624XZRFHDOOIZDXFC-UHFFFAOYSA-NNS000322352,2'-(1,4-Phenylene)bis{4-[(4-methoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one}2,2a(2)-(1,4-Phenylene)bis[4-[(4-methoxyphenyl)methylene]-5(4H)-oxazolone]
Database identifiers
- CAS
51202-86-9- PubChem CID
- 170995
- DTXSID
DTXSID8068624- UNII
- R4BK39J29W
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 95.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 881
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Compound notes
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