Basic information
- Standard SMILES
Nc1nc(C(=O)O)cc(-c2ccccc2)n1- InChIKey
LJIHHUUQWDIGDR-UHFFFAOYSA-N- Molecular formula
- C11H9N3O2
- Average molar mass
- 215.21 g/mol
- Monoisotopic mass
- 215.06947654
Names & identifiers
- Preferred name
- 2-Amino-6-phenylpyrimidine-4-carboxylic acid
- IUPAC
- 2-amino-6-phenylpyrimidine-4-carboxylic acid
Names & synonyms
2-Amino-6-phenylpyrimidine-4-carboxylic acidSCHEMBL931017LJIHHUUQWDIGDR-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 28799520
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 89.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 254
Related reactions
1 records
Compound notes
Loading…