2-[4-[4-(2-Methyl-tetrazol-5-yl)-2,6-dimethylphenoxy]-butyl]-7-azaindole

HCID 19082019
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Basic information

Standard SMILES
Cc1cc(-c2nnn(C)n2)cc(C)c1OCCCCc1cc2cccnc2[nH]1
InChIKey
LGMFGYWRVBGNRM-UHFFFAOYSA-N
Molecular formula
C21H24N6O
Average molar mass
376.5 g/mol

Names & identifiers

Preferred name
2-[4-[4-(2-Methyl-tetrazol-5-yl)-2,6-dimethylphenoxy]-butyl]-7-azaindole
IUPAC
2-[4-[2,6-dimethyl-4-(2-methyltetrazol-5-yl)phenoxy]butyl]-1H-pyrrolo[2,3-b]pyridine

Names & synonyms

SCHEMBL8925600LGMFGYWRVBGNRM-UHFFFAOYSA-N2-[4-[4-(2-methyl-tetrazol-5-yl)-2,6-dimethylphenoxy]-butyl]-7-azaindole

Database identifiers

PubChem CID
19082019

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
81.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
28

Related reactions

3 records
New reaction record

Linked notes

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