5-(2,4-dibenzyloxyphenyl)-2H-tetrazole hydrate

HCID 22010194
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Basic information

Standard SMILES
O.c1ccc(COc2ccc(-c3nn[nH]n3)c(OCc3ccccc3)c2)cc1
InChIKey
ZJUWZFFBVOSLSK-UHFFFAOYSA-N
Molecular formula
C21H20N4O3
Average molar mass
376.4 g/mol
Monoisotopic mass
376.15354051

Names & identifiers

Preferred name
5-(2,4-dibenzyloxyphenyl)-2H-tetrazole hydrate
IUPAC
5-[2,4-bis(phenylmethoxy)phenyl]-2H-tetrazole;hydrate

Names & synonyms

SCHEMBL7910945ZJUWZFFBVOSLSK-UHFFFAOYSA-N5-(2,4-dibenzyloxyphenyl)-2H-tetrazole hydrate

Database identifiers

PubChem CID
22010194

Properties

Computed structural properties

Topological polar surface area
73.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
28

Related reactions

1 records
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Compound notes

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