N1-(4-Fluorobenzyl)-N4-(1H-5-indazolyl)-1,4-cyclohexanediamine

HCID 17838166
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Basic information

Standard SMILES
Fc1ccc(CNC2CCC(Nc3ccc4[nH]ncc4c3)CC2)cc1
InChIKey
BAGADGBLBWFLIJ-UHFFFAOYSA-N
Molecular formula
C20H23FN4
Average molar mass
338.4 g/mol

Names & identifiers

Preferred name
N1-(4-Fluorobenzyl)-N4-(1H-5-indazolyl)-1,4-cyclohexanediamine
IUPAC
1-N-[(4-fluorophenyl)methyl]-4-N-(1H-indazol-5-yl)cyclohexane-1,4-diamine

Names & synonyms

SCHEMBL1717144SCHEMBL14514381SCHEMBL14514383BAGADGBLBWFLIJ-UHFFFAOYSA-NN1-(4-Fluorobenzyl)-N4-(1H-5-indazolyl)-1,4-cyclohexanediamine

Database identifiers

PubChem CID
17838166

Properties

Computed structural properties

XLogP
4
Topological polar surface area
52.7 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

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