PQ7

4-(dimethylamino)-1-{4-[4-(4-{[4-(pyrrolidin-1-yl)pyridinium-1-yl]methyl}phenyl)butyl]benzyl}pyridinium



Chemical Component Summary

Name4-(dimethylamino)-1-{4-[4-(4-{[4-(pyrrolidin-1-yl)pyridinium-1-yl]methyl}phenyl)butyl]benzyl}pyridinium
IdentifiersN,N-dimethyl-1-[[4-[4-[4-[(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)methyl]phenyl]butyl]phenyl]methyl]pyridin-1-ium-4-amine
FormulaC34 H42 N4
Molecular Weight506.724
TypeNON-POLYMER
Isomeric SMILESCN(C)c1cc[n+](cc1)Cc2ccc(cc2)CCCCc3ccc(cc3)C[n+]4ccc(cc4)N5CCCC5
InChIInChI=1S/C34H42N4/c1-35(2)33-17-23-36(24-18-33)27-31-13-9-29(10-14-31)7-3-4-8-30-11-15-32(16-12-30)28-37-25-19-34(20-26-37)38-21-5-6-22-38/h9-20,23-26H,3-8,21-22,27-28H2,1-2H3/q+2
InChIKeyOXXBKOUHROTSGV-UHFFFAOYSA-N

Chemical Details

Formal Charge2
Atom Count80
Chiral Atom Count0
Bond Count84
Aromatic Bond Count24

Related Resource References

Resource NameReference
PubChem 76317590
ChEMBL CHEMBL3140162