Basic information
- CAS
68845-92-1- Standard SMILES
COc1ccc(C2CC(=O)NC(N)=N2)c(O)c1- InChIKey
GXXQEWSSAPJDJM-UHFFFAOYSA-N- Molecular formula
- C11H13N3O3
- Average molar mass
- 235.24 g/mol
- Monoisotopic mass
- 235.09569129
Names & identifiers
- Preferred name
- 2-Amino-6-(2-hydroxy-4-methoxyphenyl)-5,6-dihydropyrimidin-4(3H)-one
- IUPAC
- 2-amino-4-(2-hydroxy-4-methoxyphenyl)-4,5-dihydro-1H-pyrimidin-6-one
Names & synonyms
68845-92-1NSC292289DTXSID503151512-Amino-6-(2-hydroxy-4-methoxyphenyl)-5,6-dihydropyrimidin-4(3H)-oneNSC-292289
Database identifiers
- CAS
68845-92-1- PubChem CID
- 325022
- DTXSID
DTXSID50315151
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 96.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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