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6-Fluoro-1-(4-fluorophenyl)-3-piperidin-4-ylindazole (HCID 21471853)|Huagongshe
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Compound
6-Fluoro-1-(4-fluorophenyl)-3-piperidin-4-ylindazole
HCID
21471853
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Properties
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Compound notes
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Basic information
Standard SMILES
Fc1ccc(-n2nc(C3CCNCC3)c3ccc(F)cc32)cc1
InChIKey
GZLZXIOXJLVSBC-UHFFFAOYSA-N
Molecular formula
C18H17F2N3
Average molar mass
313.3 g/mol
Monoisotopic mass
313.13905388
Names & identifiers
Preferred name
6-Fluoro-1-(4-fluorophenyl)-3-piperidin-4-ylindazole
IUPAC
6-fluoro-1-(4-fluorophenyl)-3-piperidin-4-ylindazole
Names & synonyms
SCHEMBL8919013
Database identifiers
PubChem CID
21471853
Properties
Computed structural properties
XLogP
3.6
Topological polar surface area
29.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
23
Formal charge
0
Complexity
394
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Related reactions
1 records
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As solvent
HRID
2145064
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Compound notes
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