5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline

C37H21NO2 — CID 59184089

IUPAC5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline
SMILESc1ccc2c(c1)oc1c(-c3c4ccccc4c(-c4cccc5c4oc4ccccc45)c4cnccc34)cccc12
InChIInChI=1S/C37H21NO2/c1-2-12-25-24(11-1)34(29-15-7-13-27-22-9-3-5-17-32(22)39-36(27)29)26-19-20-38-21-31(26)35(25)30-16-8-14-28-23-10-4-6-18-33(23)40-37(28)30/h1-21H
InChIKeyVNEPTWKREARKSM-UHFFFAOYSA-N
MW511.58 g/mol
LogP10.52
Rot. Bonds2

About 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline

5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline (PubChem CID 59184089) has the molecular formula C37H21NO2 and a molecular weight of 511.58 g/mol. Its IUPAC name is 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline.

Molecular Properties

Compound Name5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline
PubChem CID59184089
Molecular FormulaC37H21NO2
Molecular Weight511.58 g/mol
Exact Mass511.16
IUPAC Name5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline
SMILESc1ccc2c(c1)oc1c(-c3c4ccccc4c(-c4cccc5c4oc4ccccc45)c4cnccc34)cccc12
InChIInChI=1S/C37H21NO2/c1-2-12-25-24(11-1)34(29-15-7-13-27-22-9-3-5-17-32(22)39-36(27)29)26-19-20-38-21-31(26)35(25)30-16-8-14-28-23-10-4-6-18-33(23)40-37(28)30/h1-21H
InChIKeyVNEPTWKREARKSM-UHFFFAOYSA-N
XLogP10.52
TPSA39.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500511.58
LogP ≤ 510.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline 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

10-dibenzofuran-4-yl-5-naphthalen-1-ylbenzo[g]isoquinoline
CID 59183399
11-(3-dibenzofuran-4-ylphenyl)phenanthro[9,10-c]pyridine
CID 59575296
4-anthracen-9-yldibenzofuran
CID 167187282
4-[10-(2-fluoranthen-3-ylphenyl)anthracen-9-yl]dibenzofuran
CID 155454066
7-(10-dibenzofuran-4-ylanthracen-9-yl)-16-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaene
CID 153314459
3-(10-dibenzofuran-4-ylanthracen-9-yl)dibenzofuran
CID 58991746
4-(4-dibenzofuran-4-ylanthracen-9-yl)dibenzofuran
CID 88910037
8-[10-(2,6-diphenylphenyl)anthracen-9-yl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaene
CID 171447445
6-(3-methylphenyl)-[1]benzofuro[3,2-c]pyridine
CID 90139219
2-dibenzofuran-4-ylpyridine
CID 59500175
3-(3-dibenzofuran-4-ylphenyl)-1-phenyl-2,7-naphthyridine
CID 118491237
8-[4-(trideuteriomethyl)phenyl]-[1]benzofuro[2,3-c]pyridine
CID 90139294

Frequently Asked Questions

What is the IUPAC name of 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline?
The IUPAC name of 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline (CID 59184089) is 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline.
What is the SMILES notation for 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline?
The canonical SMILES for 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline is c1ccc2c(c1)oc1c(-c3c4ccccc4c(-c4cccc5c4oc4ccccc45)c4cnccc34)cccc12.
What is the InChIKey of 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline?
The InChIKey is VNEPTWKREARKSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H21NO2/c1-2-12-25-24(11-1)34(29-15-7-13-27-22-9-3-5-17-32(22)39-36(27)29)26-19-20-38-21-31(26)35(25)30-16-8-14-28-23-10-4-6-18-33(23)40-37(28)30/h1-21H.
What are the key properties of 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline?
5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline has a molecular weight of 511.58 g/mol, XLogP of 10.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10-di(dibenzofuran-4-yl)benzo[g]isoquinoline is sourced from PubChem (CID 59184089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).