Basic information
- CAS
80015-55-0- Standard SMILES
COc1ccc(COC2C(O)C(CO)OC2n2ccc(N)nc2=O)cc1- InChIKey
USLDUYHRWVHUMO-UHFFFAOYSA-N- Molecular formula
- C17H21N3O6
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.1430354
Names & identifiers
- Preferred name
- 4-Amino-1-[4-hydroxy-5-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]oxolan-2-yl]pyrimidin-2-one
- IUPAC
- 4-amino-1-[4-hydroxy-5-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]oxolan-2-yl]pyrimidin-2-one
Names & synonyms
80015-55-0NSC163563DTXSID201000908NSC-1635634-Imino-1-{2-O-[(4-methoxyphenyl)methyl]pentofuranosyl}-1,4-dihydropyrimidin-2-ol
Database identifiers
- CAS
80015-55-0- PubChem CID
- 294690
- DTXSID
DTXSID201000908
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 561
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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