Basic information
- CAS
55726-29-9- Standard SMILES
CCCC(=O)Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1- InChIKey
AVLGHOYUNPEBMO-UHFFFAOYSA-N- Molecular formula
- C13H19N3O6
- Average molar mass
- 313.31 g/mol
- Monoisotopic mass
- 313.12738533
Names & identifiers
- Preferred name
- N-[1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]butanamide
- IUPAC
- N-[1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]butanamide
Names & synonyms
55726-29-9NSC238969DTXSID60311149NSC-2389694-Butanamido-1-pentofuranosylpyrimidin-2(1H)-one
Database identifiers
- CAS
55726-29-9- PubChem CID
- 315166
- DTXSID
DTXSID60311149
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 506
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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