Basic information
- Standard SMILES
COc1ccc(C(Nc2nc3c(ncn3COC(COC(C)=O)COC(C)=O)c(=O)[nH]2)(c2ccccc2)c2ccccc2)cc1.N#N- InChIKey
OILAFEJRMZIECO-UHFFFAOYSA-N- Molecular formula
- C33H33N7O7
- Average molar mass
- 639.7 g/mol
- Monoisotopic mass
- 639.24414642
Names & identifiers
- Preferred name
- N2 (4-methoxyphenyldiphenylmethyl)-9-(1,3-diacetoxy-2-propoxymethyl)guanine
- IUPAC
- [3-acetyloxy-2-[[2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-6-oxo-1H-purin-9-yl]methoxy]propyl] acetate;molecular nitrogen
Names & synonyms
N2 (4-methoxyphenyldiphenylmethyl)-9-(1,3-diacetoxy-2-propoxymethyl)guanine
Database identifiers
- PubChem CID
- 136387274
Properties
Computed structural properties
- Topological polar surface area
- 190 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 15
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 1,010
Related reactions
5 records
Compound notes
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