Basic information
- CAS
429676-19-7- Standard SMILES
Nc1cc(OCCOCP(=O)(O)O)nc(N)n1- InChIKey
GHXCAFKFSYKTJZ-UHFFFAOYSA-N- Molecular formula
- C7H13N4O5P
- Average molar mass
- 264.18 g/mol
- Monoisotopic mass
- 264.06235653
Names & identifiers
- Preferred name
- Phosphonic acid, [[2-[(2,6-diamino-4-pyrimidinyl)oxy]ethoxy]methyl]-
- IUPAC
- 2-(2,6-diaminopyrimidin-4-yl)oxyethoxymethylphosphonic acid
Names & synonyms
2-(2,6-diaminopyrimidin-4-yl)oxyethoxymethylphosphonic acidPhosphonic acid, [[2-[(2,6-diamino-4-pyrimidinyl)oxy]ethoxy]methyl]-PMEO-DAPymPMEO-DAPy429676-19-7CHEMBL298845SCHEMBL1032922SCHEMBL29806154DTXSID70333231({2-[(2,6-diaminopyrimidin-4-yl)oxy]ethoxy}methyl)phosphonic acid6-[2-(phosphonomethoxy)ethoxy]-2,4-diaminopyrimidine
Database identifiers
- CAS
429676-19-7- PubChem CID
- 493045
- DTXSID
DTXSID70333231- ChEMBL
CHEMBL298845- Nikkaji
- J2.832.655F
Properties
Computed structural properties
- XLogP
- -2.1
- Topological polar surface area
- 154 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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