1-(2-fluorophenyl)-N,N'-di(pyrimidin-2-yl)methanediamine
Basic information
- CAS
93371-86-9- Standard SMILES
Fc1ccccc1C(Nc1ncccn1)Nc1ncccn1- InChIKey
BHESAQNRXOZUNQ-UHFFFAOYSA-N- Molecular formula
- C15H13FN6
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.1185726
Names & identifiers
- Preferred name
- 1-(2-fluorophenyl)-N,N'-di(pyrimidin-2-yl)methanediamine
- IUPAC
- 1-(2-fluorophenyl)-N,N'-di(pyrimidin-2-yl)methanediamine
Names & synonyms
93371-86-91-(2-fluorophenyl)-N,N'-di(pyrimidin-2-yl)methanediamineNSC322060DTXSID30317931NSC-322060
Database identifiers
- CAS
93371-86-9- PubChem CID
- 331272
- DTXSID
DTXSID30317931
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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