Compound Summary


WB 64
  Compound Information
 WB 64

Compound Name:

WB 64

Compound CID:

405252

Synonyms:

WB 64

WB64

NCGC00016096-01

Lopac-W-4761

Lopac0_001268

More...

Iupac Name:

3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl-[6-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium

InChI:

InChI=1S/C40H48N4O4/c1-43(2,27-13-23-41-37(45)31-19-9-15-29-16-10-20-32(35(29)31)38(41)46)25-7-5-6-8-26-44(3,4)28-14-24-42-39(47)33-21-11-17-30-18-12-22-34(36(30)33)40(42)48/h9-12,15-22H,5-8,13-14,23-28H2,1-4H3/q+2

InChIKey:

WNTBFLNHQQTHSU-UHFFFAOYSA-N

Canonical Smiles:

C[N+](C)(CCCCCC[N+](C)(C)CCCN1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O)CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

Isomeric Smiles:

C[N+](C)(CCCCCC[N+](C)(C)CCCN1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O)CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

Molecular Weight:

648.8

Molecular Formula:

C40H48N4O4+2

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 WB 64

Molecular Weight:

648.8

Molecular Formula:

C40H48N4O4+2

Hydrogen Bond Donor Count:

0

Hydrogen Bond Acceptor Count:

4

Rotatable Bond Count:

15

Heavy Atom Count:

48

Complexity:

1030

  Synonyms
 WB 64

WB 64 WB 64

WB 64

WB64

NCGC00016096-01

Lopac-W-4761

Lopac0_001268

cid_405251

CHEMBL1182747

BDBM80806

DTXSID601018012

CCG-205341

NCGC00016096-02

NCGC00016096-03

NCGC00162384-01

1,6-Bis3-(1,3-dioxo-2,3-dihydro-1H-benzodeisoquinoline-2-yl)propyldimethylaminiohexane

3-(1,3-diketobenzodeisoquinolin-2-yl)propyl-6-3-(1,3-diketobenzodeisoquinolin-2-yl)propyl-dimethyl-ammoniohexyl-dimethyl-ammonium;bromide

3-(1,3-dioxo-2-benzodeisoquinolinyl)propyl-6-3-(1,3-dioxo-2-benzodeisoquinolinyl)propyl-dimethylammoniohexyl-dimethylammonium;bromide

3-(1,3-Dioxobenzodeisoquinolin-2-yl)propyl-6-3-(1,3-dioxobenzodeisoquinolin-2-yl)propyl-dimethyl-ammoniohexyl-dimethyl-ammonium

3-(1,3-dioxobenzodeisoquinolin-2-yl)propyl-6-3-(1,3-dioxobenzodeisoquinolin-2-yl)propyl-dimethylazaniumylhexyl-dimethylazanium;bromide

3-1,3-bis(oxidanylidene)benzodeisoquinolin-2-ylpropyl-6-3-1,3-bis(oxidanylidene)benzodeisoquinolin-2-ylpropyl-dimethyl-azaniumylhexyl-dimethyl-azanium;bromide

767625-84-3

N,N-Bis3-(1,3-dioxo-1H-benzodeisoquinolin-2(3H)-yl)propyl-N,N,N,N-tetramethyl-1,6-hexanebis(aminium)"

  Experimental Data
 WB 64

Species Dose Unit Control(Avg days) Treatment(Avg days) Avg/Med Lifespan Change(%) Control(Max days) Treatment(Max days) Max Lifespan Change(%) Significant Strain Gender PubMed Avg/Med Lifespan Change tab
Caenorhabditis elegans 33.000000000000000 umol/L 13.000000000000000 NS N2 24134630 Inactive
  Experimental Data Visualization
 WB 64

  Statistics Data
 WB 64

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans 13.000000000000000 1 1
  Statistics Data Visualization
 WB 64