Basic information
- CAS
19148-32-4- Standard SMILES
N#Cc1nc2c(N)nc(-c3ccccc3)nc2nc1N- InChIKey
HCKFMGUQQVLORQ-UHFFFAOYSA-N- Molecular formula
- C13H9N7
- Average molar mass
- 263.26 g/mol
- Monoisotopic mass
- 263.09194332
Names & identifiers
- Preferred name
- 4,7-Diamino-2-phenylpteridine-6-carbonitrile
- IUPAC
- 4,7-diamino-2-phenylpteridine-6-carbonitrile
Names & synonyms
4,7-diamino-2-phenylpteridine-6-carbonitrile19148-32-4DTXSID00291158RefChem:286028DTXCID20242304NSC73557NSC-735574,7-diamino-6-cyano-2-phenylpteridine
Database identifiers
- CAS
19148-32-4- PubChem CID
- 252201
- DTXSID
DTXSID00291158
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 385
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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