Basic information
- Standard SMILES
COc1ccc(-c2cnc(N)c(C(=O)c3ccc(N)nc3)c2)cc1OC- InChIKey
UBHKHIJBAPXYNE-UHFFFAOYSA-N- Molecular formula
- C19H18N4O3
- Average molar mass
- 350.4 g/mol
Names & identifiers
- Preferred name
- [2-Amino-5-(3,4-dimethoxy-phenyl)-pyridin-3-yl]-(6-amino-pyridin-3-yl)-methanone
- IUPAC
- [2-amino-5-(3,4-dimethoxyphenyl)-3-pyridinyl]-(6-amino-3-pyridinyl)methanone
Names & synonyms
SCHEMBL1478747UBHKHIJBAPXYNE-UHFFFAOYSA-NDB-372424[2-amino-5-(3,4-dimethoxy-phenyl)-pyridin-3-yl]-(6-amino-pyridin-3-yl)-methanone[2-Amino-5-(3,4-dimethoxyphenyl)-3-pyridinyl](6-amino-3-pyridinyl)methanone875639-62-6
Database identifiers
- PubChem CID
- 59699897
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 478
Related reactions
12 records
Compound notes
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