Basic information
- Standard SMILES
NCCc1ncc(-c2ncc[nH]2)c(-c2ccc(Cl)cc2Cl)n1- InChIKey
QJUHUJSJDRYPHY-UHFFFAOYSA-N- Molecular formula
- C15H13Cl2N5
- Average molar mass
- 334.2 g/mol
- Monoisotopic mass
- 333.0548008
Names & identifiers
- Preferred name
- 4-(2,4-Dichlorophenyl)-5-imidazolylpyrimidin-2-ylethylamine
- IUPAC
- 2-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)pyrimidin-2-yl]ethanamine
Names & synonyms
SCHEMBL5089403QJUHUJSJDRYPHY-UHFFFAOYSA-N4-(2,4-dichlorophenyl)-5-imidazolylpyrimidin-2-ylethylamine4-(2,4-dichloro-phenyl)-5-imidazol-2-ylpyrimidin-2-ylethylamine4-(2,4-dichlorophenyl)-5-imidazol-2-ylpyrimidin-2-ylethylamine
Database identifiers
- PubChem CID
- 54231773
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 359
Related reactions
38 records
Linked notes
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