Basic information
- Standard SMILES
Cc1ccc(Oc2ccc(Nc3ncnc(Cl)c3[N+](=O)[O-])cc2C)cn1.Cl- InChIKey
MUDBZUNLXBGGMY-UHFFFAOYSA-N- Molecular formula
- C17H15Cl2N5O3
- Average molar mass
- 408.2 g/mol
- Monoisotopic mass
- 407.0551947
Names & identifiers
- Preferred name
- 6-chloro-N-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl}-5-nitropyrimidin-4-amine hydrochloride
- IUPAC
- 6-chloro-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]-5-nitropyrimidin-4-amine;hydrochloride
Names & synonyms
SCHEMBL2748904MUDBZUNLXBGGMY-UHFFFAOYSA-N6-chloro-N-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl}-5-nitropyrimidin-4-amine hydrochloride
Database identifiers
- PubChem CID
- 86615744
Properties
Computed structural properties
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 480
Related reactions
4 records
Compound notes
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