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5-Fluoro-2-(4-fluorophenoxy)-N-[4-(2H-tetrazol-5-YL)benzyl]benzamide

HCID 58905365
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=C(NCc1ccc(-c2nn[nH]n2)cc1)c1cc(F)ccc1Oc1ccc(F)cc1
InChIKey
TVMLQMWDYHMBNA-UHFFFAOYSA-N
Molecular formula
C21H15F2N5O2
Average molar mass
407.4 g/mol

Names & identifiers

Preferred name
5-Fluoro-2-(4-fluorophenoxy)-N-[4-(2H-tetrazol-5-YL)benzyl]benzamide
IUPAC
5-fluoro-2-(4-fluorophenoxy)-N-[[4-(2H-tetrazol-5-yl)phenyl]methyl]benzamide

Names & synonyms

SCHEMBL4450530TVMLQMWDYHMBNA-UHFFFAOYSA-N5-FLUORO-2-(4-FLUOROPHENOXY)-N-[4-(2H-TETRAZOL-5-YL)BENZYL]BENZAMIDE

Database identifiers

PubChem CID
58905365

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
92.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
30
Formal charge
0
Complexity
556

Related reactions

2 records
New reaction record
HRID 837675 reaction equation
HRID 837675As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1293229 reaction equation
HRID 1293229As productuspto-grants-2007_07

Compound notes

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