(1Z)-1-[2-(6-Amino-7H-purin-8-yl)hydrazinylidene]naphthalen-2(1H)-one
Basic information
- CAS
6935-68-8- Standard SMILES
Nc1ncnc2nc(N=Nc3c(O)ccc4ccccc34)[nH]c12- InChIKey
MNAOWHXKCJFRGT-UHFFFAOYSA-N- Molecular formula
- C15H11N7O
- Average molar mass
- 305.29 g/mol
- Monoisotopic mass
- 305.102508
Names & identifiers
- Preferred name
- (1Z)-1-[2-(6-Amino-7H-purin-8-yl)hydrazinylidene]naphthalen-2(1H)-one
- IUPAC
- 1-[(6-amino-7H-purin-8-yl)diazenyl]naphthalen-2-ol
Names & synonyms
6935-68-8NSC23587DTXSID90713915NSC-23587(1Z)-1-[2-(6-Amino-7H-purin-8-yl)hydrazinylidene]naphthalen-2(1H)-one
Database identifiers
- CAS
6935-68-8- PubChem CID
- 229728
- DTXSID
DTXSID90713915
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 448
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Compound notes
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