{3-[1-Butyl-2-[3-(4-tert-butyl-phenoxy)-phenyl]-6-(3-diethylaminopropoxy)-1H-benzimidazole-4-yloxy]-propyl}diethyl-amine

HCID 59699062

Basic information

Standard SMILES
CCCCn1c(-c2cccc(Oc3ccc(C(C)(C)C)cc3)c2)nc2c(OCCCN(CC)CC)cc(OCCCN(CC)CC)cc21
InChIKey
MCQKTHYAZUQUGX-UHFFFAOYSA-N
Molecular formula
C41H60N4O3
Average molar mass
656.9 g/mol

Names & identifiers

Preferred name
{3-[1-Butyl-2-[3-(4-tert-butyl-phenoxy)-phenyl]-6-(3-diethylaminopropoxy)-1H-benzimidazole-4-yloxy]-propyl}diethyl-amine
IUPAC
3-[3-butyl-2-[3-(4-tert-butylphenoxy)phenyl]-7-[3-(diethylamino)propoxy]benzimidazol-5-yl]oxy-N,N-diethylpropan-1-amine

Names & synonyms

SCHEMBL1283736MCQKTHYAZUQUGX-UHFFFAOYSA-N{3-[1-Butyl-2-[3-(4-tert-butyl-phenoxy)-phenyl]-6-(3-diethylaminopropoxy)-1H-benzimidazole-4-yloxy]-propyl}diethyl-amine

Database identifiers

PubChem CID
59699062

Properties

Computed structural properties

XLogP
9.7
Topological polar surface area
52 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
21
Heavy atoms
48

Related reactions

3 records

Compound notes

Loading…