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5-[4-[(N'-propylcarbamimidoyl)amino]pyrimidin-2-yl]pentanimidamide (HCID 20137150)|Huagongshe
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Compound
5-[4-[(N'-propylcarbamimidoyl)amino]pyrimidin-2-yl]pentanimidamide
HCID
20137150
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Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCCN=C(N)Nc1ccnc(CCCCC(=N)N)n1
InChIKey
ZBBSIOXIXZMNEL-UHFFFAOYSA-N
Molecular formula
C13H23N7
Average molar mass
277.37 g/mol
Names & identifiers
Preferred name
5-[4-[(N'-propylcarbamimidoyl)amino]pyrimidin-2-yl]pentanimidamide
IUPAC
5-[4-[(N'-propylcarbamimidoyl)amino]pyrimidin-2-yl]pentanimidamide
Names & synonyms
SCHEMBL10630496
Database identifiers
PubChem CID
20137150
Properties
Computed structural properties
XLogP
0.1
Topological polar surface area
126 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
20
Formal charge
0
Complexity
316
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Related reactions
1 records
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As reactant
As product
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As solvent
HRID
182399
As product
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Compound notes
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