(R)-3-(5-acetoxyhexyl)-1-methyl-6,7,8,9-tetrahydro-pyrimido[2, 1-f]purine-2,4(1H,3H)-dione
Basic information
- Standard SMILES
CC(=O)O[C@H](C)CCCCn1c(=O)c2c(nc3n2CCCN3)n(C)c1=O- InChIKey
XRNAMZYZWCVYJZ-LLVKDONJSA-N- Molecular formula
- C17H25N5O4
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.1906543
Names & identifiers
- Preferred name
- (R)-3-(5-acetoxyhexyl)-1-methyl-6,7,8,9-tetrahydro-pyrimido[2, 1-f]purine-2,4(1H,3H)-dione
- IUPAC
- [(2R)-6-(1-methyl-2,4-dioxo-6,7,8,9-tetrahydropurino[7,8-a]pyrimidin-3-yl)hexan-2-yl] acetate
Names & synonyms
SCHEMBL4707367XRNAMZYZWCVYJZ-LLVKDONJSA-N(R)-3-(5-acetoxyhexyl)-1-methyl-6,7,8,9-tetrahydro-pyrimido[2, 1-f]purine-2,4(1H,3H)-dione(R)-3-(5-acetoxyhexyl)-1-methyl-6,7,8,9-tetrahydro-pyrimido[2,1-f]purine-2,4(1H,3H)-dione
Database identifiers
- PubChem CID
- 136368770
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 96.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 571
Related reactions
4 records
Compound notes
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