Basic information
- CAS
573972-27-7- Standard SMILES
N#Cc1c(-c2cccnc2)cc(-c2ccccc2)nc1N- InChIKey
FBSRDNIWDUKMQY-UHFFFAOYSA-N- Molecular formula
- C17H12N4
- Average molar mass
- 272.3 g/mol
- Monoisotopic mass
- 272.1061964
Names & identifiers
- Preferred name
- 2-Amino-6-phenyl-4-pyridin-3-ylpyridine-3-carbonitrile
- IUPAC
- 2-amino-6-phenyl-4-pyridin-3-ylpyridine-3-carbonitrile
Names & synonyms
2-amino-6-phenyl-4-pyridin-3-ylpyridine-3-carbonitrile573972-27-7MLS000333110CHEMBL1299818DTXSID101327498HMS2790A21STL340885AKOS022135696SMR0004364132'-amino-6'-phenyl-3,4'-bipyridine-3'-carbonitrile2'-Amino-6'-phenyl-[3,4']bipyridinyl-3'-carbonitrile2'-Amino-6'-phenyl[3,4'-bipyridine]-3'-carbonitrile
Show more names
2'-AMINO-6'-PHENYL-[3,4'-BIPYRIDINE]-3'-CARBONITRILE
Database identifiers
- CAS
573972-27-7- PubChem CID
- 936638
- DTXSID
DTXSID101327498- ChEMBL
CHEMBL1299818
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 381
Experimental & physicochemical properties
Solubility2.4 [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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