3-Amino-2-[4-(5-bromo-3-methylpyrid-2-yl)-butylamino]-5-(pyrid-3-ylmethyl)pyridine

HCID 19851789
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Basic information

Standard SMILES
Cc1cc(Br)cnc1CCCCNc1ncc(Cc2cccnc2)cc1N
InChIKey
AHVUPYPUBFOKFG-UHFFFAOYSA-N
Molecular formula
C21H24BrN5
Average molar mass
426.4 g/mol

Names & identifiers

Preferred name
3-Amino-2-[4-(5-bromo-3-methylpyrid-2-yl)-butylamino]-5-(pyrid-3-ylmethyl)pyridine
IUPAC
2-N-[4-(5-bromo-3-methyl-2-pyridinyl)butyl]-5-(pyridin-3-ylmethyl)pyridine-2,3-diamine

Names & synonyms

SCHEMBL10365057AHVUPYPUBFOKFG-UHFFFAOYSA-N3-Amino-2-[4-(5-bromo-3-methylpyrid-2-yl)-butylamino]-5-(pyrid-3-ylmethyl)pyridine3-Amino-2-[4-(5-bromo-3-methylpyrid-2-yl)butylamino]-5-(pyrid-3-ylmethyl)pyridine

Database identifiers

PubChem CID
19851789

Properties

Computed structural properties

XLogP
4
Topological polar surface area
76.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
27

Related reactions

5 records
New reaction record

Compound notes

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3-Amino-2-[4-(5-bromo-3-methylpyrid-2-yl)-butylamino]-5-(pyrid-3-ylmethyl)pyridine (HCID 19851789)｜Huagongshe