Benzo[1,3]dioxol-5-ylmethyl-(1h-benzoimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amine

HCID 21985019

Basic information

Standard SMILES
c1cnc2c(c1)CCCC2N(Cc1ccc2c(c1)OCO2)Cc1nc2ccccc2[nH]1
InChIKey
AFTZKEJJJQJQMX-UHFFFAOYSA-N
Molecular formula
C25H24N4O2
Average molar mass
412.5 g/mol

Names & identifiers

Preferred name
Benzo[1,3]dioxol-5-ylmethyl-(1h-benzoimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amine
IUPAC
N-(1H-benzimidazol-2-ylmethyl)-N-(1,3-benzodioxol-5-ylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine

Names & synonyms

SCHEMBL2507198AFTZKEJJJQJQMX-UHFFFAOYSA-Nbenzo[1,3 ]dioxol-5-ylmethyl-(1h-benzoimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-aminebenzo[1,3]dioxol-5-ylmethyl-( 1H-benzoimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-aminebenzo[1,3]dioxol-5-ylmethyl-(1h-benzoimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amine

Database identifiers

PubChem CID
21985019

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
63.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
31

Related reactions

3 records

Compound notes

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