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N'-[7-(2,4-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]ethane-1,2-diamine (HCID 59312935)|Huagongshe
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Compound
N'-[7-(2,4-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]ethane-1,2-diamine
HCID
59312935
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
NCCNc1nc(-c2ccc(Cl)cc2Cl)cc2nccn12
InChIKey
UNRXEODYFOVDLU-UHFFFAOYSA-N
Molecular formula
C14H13Cl2N5
Average molar mass
322.2 g/mol
Monoisotopic mass
321.0548008
Names & identifiers
Preferred name
N'-[7-(2,4-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]ethane-1,2-diamine
IUPAC
N'-[7-(2,4-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]ethane-1,2-diamine
Names & synonyms
SCHEMBL10270149
Database identifiers
PubChem CID
59312935
Properties
Computed structural properties
XLogP
3.4
Topological polar surface area
68.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
345
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Related reactions
5 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
696281
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID
697072
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID
2138651
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID
2340445
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID
2342692
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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Compound notes
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