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1,12-Bis(2-amino-3,4,5,6-tetrahydropyrimidyl)dodecane dihydroiodide

HCID 19088834
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Basic information

Standard SMILES
I.I.NC1=NCCCN1CCCCCCCCCCCCN1CCCN=C1N
InChIKey
MCCBUSFWUIQQGR-UHFFFAOYSA-N
Molecular formula
C20H42I2N6
Average molar mass
620.4 g/mol

Names & identifiers

Preferred name
1,12-Bis(2-amino-3,4,5,6-tetrahydropyrimidyl)dodecane dihydroiodide
IUPAC
1-[12-(2-amino-5,6-dihydro-4H-pyrimidin-1-yl)dodecyl]-5,6-dihydro-4H-pyrimidin-2-amine;dihydroiodide

Names & synonyms

MCCBUSFWUIQQGR-UHFFFAOYSA-N1,12-bis(2-amino-3,4,5,6-tetrahydropyrimidyl)dodecane dihydroiodide

Database identifiers

PubChem CID
19088834

Properties

Computed structural properties

Topological polar surface area
83.2 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
2
Rotatable bonds
13
Heavy atoms
28
Formal charge
0
Complexity
394

Related reactions

1 records
New reaction record
HRID 5033 reaction equation
HRID 5033As reactantuspto-grants-1993_09

Compound notes

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