N-(4-Methoxyphenyl)-9-pentofuranosyl-9H-purin-6-amine
Basic information
- CAS
29204-77-1- Standard SMILES
COc1ccc(Nc2ncnc3c2ncn3C2OC(CO)C(O)C2O)cc1- InChIKey
DHSVZMSVSTXYCS-UHFFFAOYSA-N- Molecular formula
- C17H19N5O5
- Average molar mass
- 373.4 g/mol
- Monoisotopic mass
- 373.13861872
Names & identifiers
- Preferred name
- N-(4-Methoxyphenyl)-9-pentofuranosyl-9H-purin-6-amine
- IUPAC
- 2-(hydroxymethyl)-5-[6-(4-methoxyanilino)purin-9-yl]oxolane-3,4-diol
Names & synonyms
29204-77-1NSC337774N6-p-MethoxyphenyladenosinAdenosine,n-(4-methoxyphenyl)-N-(4-Methoxyphenyl)-9-pentofuranosyl-9H-purin-6-amineDTXSID90318242NSC327924NSC-327924NSC-337774DS-009697
Database identifiers
- CAS
29204-77-1- PubChem CID
- 332073
- DTXSID
DTXSID90318242
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 494
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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