7-Methoxy-3-(4-methylphenyl)-2-phenyl-4H-1-benzopyran-4-one
Basic information
- CAS
59208-57-0- Standard SMILES
COc1ccc2c(=O)c(-c3ccc(C)cc3)c(-c3ccccc3)oc2c1- InChIKey
STZVNNYMWXHTCM-UHFFFAOYSA-N- Molecular formula
- C23H18O3
- Average molar mass
- 342.4 g/mol
- Monoisotopic mass
- 342.12559443
Names & identifiers
- Preferred name
- 7-Methoxy-3-(4-methylphenyl)-2-phenyl-4H-1-benzopyran-4-one
- IUPAC
- 7-methoxy-3-(4-methylphenyl)-2-phenylchromen-4-one
Names & synonyms
59208-57-07-Methoxy-3-(4-methylphenyl)-2-phenyl-4H-1-benzopyran-4-oneRefChem:310965MLS000518022KUC100665N7-Methoxy-2-phenyl-3-p-tolylchromen-4-oneCHEMBL1704007DTXSID501187462HMS3096B13SMR000327224
Database identifiers
- CAS
59208-57-0- PubChem CID
- 11624305
- DTXSID
DTXSID501187462- ChEMBL
CHEMBL1704007- Nikkaji
- J2.291.405G
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 538
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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