Basic information
- Standard SMILES
Nc1ccc(Oc2nccc(-c3cccnc3)n2)cc1[N+](=O)[O-]- InChIKey
ZRSLJOXAHACGPX-UHFFFAOYSA-N- Molecular formula
- C15H11N5O3
- Average molar mass
- 309.28 g/mol
Names & identifiers
- Preferred name
- 2-Nitro-4-(4-(3-pyridyl)pyrimidin-2-yloxy)phenylamine
- IUPAC
- 2-nitro-4-(4-pyridin-3-ylpyrimidin-2-yl)oxyaniline
Names & synonyms
SCHEMBL2891535ZRSLJOXAHACGPX-UHFFFAOYSA-N2-nitro-4-(4-(3-pyridyl)pyrimidin-2-yloxy)phenylamine
Database identifiers
- PubChem CID
- 22041340
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 405
Related reactions
10 records
Compound notes
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