Basic information
- CAS
23042-09-3- Standard SMILES
CNc1ncnc2ncn(C3OC(CO)C(O)C3O)c12- InChIKey
PKHOOEXUYPKBDG-UHFFFAOYSA-N- Molecular formula
- C11H15N5O4
- Average molar mass
- 281.27 g/mol
- Monoisotopic mass
- 281.11240398
Names & identifiers
- Preferred name
- n-Methyl-7-pentofuranosyl-7h-purin-6-amine
- IUPAC
- 2-(hydroxymethyl)-5-[6-(methylamino)purin-7-yl]oxolane-3,4-diol
Names & synonyms
23042-09-3n-methyl-7-pentofuranosyl-7h-purin-6-amineNSC131661DTXSID40945724NSC-131661
Database identifiers
- CAS
23042-09-3- PubChem CID
- 280216
- DTXSID
DTXSID40945724
Properties
Computed structural properties
- XLogP
- -1.2
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 349
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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