2-(4-Methylphenyl)-3-phenylquinoxaline
Basic information
- CAS
36305-53-0- Standard SMILES
Cc1ccc(-c2nc3ccccc3nc2-c2ccccc2)cc1- InChIKey
UVRYQXVGHZOOQP-UHFFFAOYSA-N- Molecular formula
- C21H16N2
- Average molar mass
- 296.4 g/mol
- Monoisotopic mass
- 296.13134852
Names & identifiers
- Preferred name
- 2-(4-Methylphenyl)-3-phenylquinoxaline
- IUPAC
- 2-(4-methylphenyl)-3-phenylquinoxaline
Names & synonyms
2-(4-methylphenyl)-3-phenylquinoxaline36305-53-0RefChem:252670MLS001163506SCHEMBL8407630CHEMBL1452056DTXSID301282903HMS2813B16SMR000497315
Database identifiers
- CAS
36305-53-0- PubChem CID
- 2295348
- DTXSID
DTXSID301282903- ChEMBL
CHEMBL1452056- Nikkaji
- J1.978.893H
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 368
Experimental & physicochemical properties
Solubility1 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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