Basic information
- Standard SMILES
CC(=O)Nc1nc2ncn(Cc3ccccc3)c2c(=O)[nH]1.N#N- InChIKey
GZRCGRPDJMLPCS-UHFFFAOYSA-N- Molecular formula
- C14H13N7O2
- Average molar mass
- 311.3 g/mol
- Monoisotopic mass
- 311.11307268
Names & identifiers
- Preferred name
- N2 acetyl-7-benzylguanine
- IUPAC
- N-(7-benzyl-6-oxo-1H-purin-2-yl)acetamide;molecular nitrogen
Names & synonyms
N2 acetyl-7-benzylguanineGZRCGRPDJMLPCS-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 136365317
Properties
Computed structural properties
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 466
Related reactions
4 records
Compound notes
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