5-Ethoxycarbonyl-2-[3-(3-piperidinomethylphenoxy)propyl]benzimidazole

HCID 21294573
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)c1ccc2nc(CCCOc3cccc(CN4CCCCC4)c3)[nH]c2c1
InChIKey
USFAWMRFLMEUAK-UHFFFAOYSA-N
Molecular formula
C25H31N3O3
Average molar mass
421.5 g/mol

Names & identifiers

Preferred name
5-Ethoxycarbonyl-2-[3-(3-piperidinomethylphenoxy)propyl]benzimidazole
IUPAC
ethyl 2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-3H-benzimidazole-5-carboxylate

Names & synonyms

SCHEMBL10666568SCHEMBL10666587USFAWMRFLMEUAK-UHFFFAOYSA-N5-ethoxycarbonyl-2-[3-(3-piperidinomethylphenoxy)propyl]benzimidazole

Database identifiers

PubChem CID
21294573

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
67.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
31

Related reactions

1 records
New reaction record

Compound notes

Loading…