Basic information
- Standard SMILES
Nc1ccc(Oc2nccc(-c3cccnc3)n2)cc1N- InChIKey
GCEPYWXJPCACOW-UHFFFAOYSA-N- Molecular formula
- C15H13N5O
- Average molar mass
- 279.3 g/mol
Names & identifiers
- Preferred name
- 4-(4-(3-Pyridyl)pyrimidin-2-yloxy)benzene-1,2-diamine
- IUPAC
- 4-(4-pyridin-3-ylpyrimidin-2-yl)oxybenzene-1,2-diamine
Names & synonyms
SCHEMBL2890146GCEPYWXJPCACOW-UHFFFAOYSA-N4-(4-(3-pyridyl)pyrimidin-2-yloxy)benzene-1,2-diamine
Database identifiers
- PubChem CID
- 22041328
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 99.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 329
Related reactions
9 records
Compound notes
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