6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium

C26H18N2+2 — CID 102442616

IUPAC6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium
SMILESc1ccc2c(c1)c(-c1cc3cccc[n+]3c3ccccc13)cc1cccc[n+]12
InChIInChI=1S/C26H18N2/c1-3-13-25-21(11-1)23(17-19-9-5-7-15-27(19)25)24-18-20-10-6-8-16-28(20)26-14-4-2-12-22(24)26/h1-18H/q+2
InChIKeyWZDCBZJTEMOQCP-UHFFFAOYSA-N
MW358.44 g/mol
LogP5.14
Rot. Bonds1

About 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium

6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium (PubChem CID 102442616) has the molecular formula C26H18N2+2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium.

Molecular Properties

Compound Name6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium
PubChem CID102442616
Molecular FormulaC26H18N2+2
Molecular Weight358.44 g/mol
Exact Mass358.15
IUPAC Name6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium
SMILESc1ccc2c(c1)c(-c1cc3cccc[n+]3c3ccccc13)cc1cccc[n+]12
InChIInChI=1S/C26H18N2/c1-3-13-25-21(11-1)23(17-19-9-5-7-15-27(19)25)24-18-20-10-6-8-16-28(20)26-14-4-2-12-22(24)26/h1-18H/q+2
InChIKeyWZDCBZJTEMOQCP-UHFFFAOYSA-N
XLogP5.14
TPSA8.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzo[c]quinolizin-11-ium-6-ol;ethane
CID 142839036
benzo[c]quinolizin-11-ium-6-amine;hydrochloride
CID 22987948
N-benzo[c]quinolizin-11-ium-6-ylacetamide chloride
CID 10401057
N-benzo[c]quinolizin-11-ium-6-ylacetamide;ethane
CID 142839022
8-bromobenzo[c]quinolizin-11-ium-6-ol chloride
CID 10470674
7-fluorobenzo[c]quinolizin-11-ium-6-ol chloride
CID 11482070
9-chloro-6-iodobenzo[c]quinolizin-11-ium;chloromethane
CID 143047720
6-methylbenzo[b]quinolizin-5-ium hexafluorophosphate
CID 19381116
benzo[b]quinolizin-5-ium-6-carbonitrile perchlorate
CID 19047539
1-phenyl-4-(1-phenylquinolin-1-ium-4-yl)quinolin-1-ium
CID 137387679
6,7-bis(4-bromophenyl)benzo[a]quinolizin-5-ium
CID 102219187
CID 177394176
CID 177394176

Frequently Asked Questions

What is the IUPAC name of 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium?
The IUPAC name of 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium (CID 102442616) is 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium.
What is the SMILES notation for 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium?
The canonical SMILES for 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium is c1ccc2c(c1)c(-c1cc3cccc[n+]3c3ccccc13)cc1cccc[n+]12.
What is the InChIKey of 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium?
The InChIKey is WZDCBZJTEMOQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2/c1-3-13-25-21(11-1)23(17-19-9-5-7-15-27(19)25)24-18-20-10-6-8-16-28(20)26-14-4-2-12-22(24)26/h1-18H/q+2.
What are the key properties of 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium?
6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium has a molecular weight of 358.44 g/mol, XLogP of 5.14, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzo[c]quinolizin-11-ium-6-ylbenzo[c]quinolizin-11-ium is sourced from PubChem (CID 102442616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).