Basic information
- Standard SMILES
COc1cc(OC)nc(Oc2cccc3c2C(=O)OC3O)n1- InChIKey
AXGFDUVCBOFWKW-UHFFFAOYSA-N- Molecular formula
- C14H12N2O6
- Average molar mass
- 304.25 g/mol
Names & identifiers
- Preferred name
- 7-[(4,6-Dimethoxy-pyrimidin-2-yl)oxy]-3-hydroxy-phthalide
- IUPAC
- 7-(4,6-dimethoxypyrimidin-2-yl)oxy-3-hydroxy-3H-2-benzofuran-1-one
Names & synonyms
SCHEMBL9141164AXGFDUVCBOFWKW-UHFFFAOYSA-N7-[(4,6-dimethoxy-pyrimidin-2-yl)oxy]-3-hydroxy-phthalide
Database identifiers
- PubChem CID
- 19927417
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 397
Related reactions
21 records
Linked notes
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