Basic information
- CAS
5434-92-4- Standard SMILES
O=C1NC(=O)C(O)(Cc2ccccn2)C(=O)N1- InChIKey
AVCKKGDHUCWQCY-UHFFFAOYSA-N- Molecular formula
- C10H9N3O4
- Average molar mass
- 235.2 g/mol
- Monoisotopic mass
- 235.05930578
Names & identifiers
- Preferred name
- 5-Hydroxy-5-(pyridin-2-ylmethyl)-1,3-diazinane-2,4,6-trione
- IUPAC
- 5-hydroxy-5-(pyridin-2-ylmethyl)-1,3-diazinane-2,4,6-trione
Names & synonyms
5434-92-4NSC15137DTXSID80969429NSC-151374,5,6-Trihydroxy-5-[(pyridin-2-yl)methyl]pyrimidin-2(5H)-one
Database identifiers
- CAS
5434-92-4- PubChem CID
- 225575
- DTXSID
DTXSID80969429
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 349
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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