2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline

C37H23N3 — CID 139364038

IUPAC2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline
SMILESc1ccc2cc3nc(-c4cc(-c5ccncc5)cc(-c5ccc6cc7ccccc7cc6n5)c4)ccc3cc2c1
InChIInChI=1S/C37H23N3/c1-3-7-27-22-36-29(17-25(27)5-1)9-11-34(39-36)32-19-31(24-13-15-38-16-14-24)20-33(21-32)35-12-10-30-18-26-6-2-4-8-28(26)23-37(30)40-35/h1-23H
InChIKeyVOJZUEGJWWJORR-UHFFFAOYSA-N
MW509.61 g/mol
LogP9.49
Rot. Bonds3

About 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline

2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline (PubChem CID 139364038) has the molecular formula C37H23N3 and a molecular weight of 509.61 g/mol. Its IUPAC name is 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline.

Molecular Properties

Compound Name2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline
PubChem CID139364038
Molecular FormulaC37H23N3
Molecular Weight509.61 g/mol
Exact Mass509.19
IUPAC Name2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline
SMILESc1ccc2cc3nc(-c4cc(-c5ccncc5)cc(-c5ccc6cc7ccccc7cc6n5)c4)ccc3cc2c1
InChIInChI=1S/C37H23N3/c1-3-7-27-22-36-29(17-25(27)5-1)9-11-34(39-36)32-19-31(24-13-15-38-16-14-24)20-33(21-32)35-12-10-30-18-26-6-2-4-8-28(26)23-37(30)40-35/h1-23H
InChIKeyVOJZUEGJWWJORR-UHFFFAOYSA-N
XLogP9.49
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500509.61
LogP ≤ 59.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[3-benzo[g]quinolin-2-yl-5-(3-quinolin-2-ylphenyl)phenyl]benzo[g]quinoline
CID 139363878
2-phenylbenzo[g]quinoline
CID 45113076
2-(3-benzo[g]quinolin-2-yl-5-quinolin-3-ylphenyl)benzo[g]quinoline
CID 139364036
2-(3-benzo[g]quinolin-2-yl-5-quinolin-8-ylphenyl)benzo[g]quinoline
CID 139364035
2-[3-[2-(3,5-dipyridin-2-ylphenyl)quinolin-6-yl]phenyl]benzo[g]quinoline
CID 139363998
2-[3-benzo[g]quinolin-2-yl-5-(10-quinolin-2-ylanthracen-9-yl)phenyl]benzo[g]quinoline
CID 139364165
2-[3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]benzo[g]quinoline
CID 139363955
2-(3,5-dipyridin-4-ylphenyl)-4,6-dinaphthalen-2-ylpyrimidine
CID 118582461
2-(6-benzo[g]quinolin-2-yl-4-pyrimidin-2-yl-2-pyridinyl)benzo[g]quinoline
CID 139364007
2-[2-(3,5-dipyridin-4-ylphenyl)-5,5,10,10-tetramethylindeno[2,1-a]inden-7-yl]quinoline
CID 90068471
2-(3-naphthalen-2-ylphenyl)-9-pyridin-4-yl-1,10-phenanthroline
CID 134167550
2-naphthalen-1-yl-6-(2-pyridin-4-ylquinolin-7-yl)quinoline
CID 155023288

Frequently Asked Questions

What is the IUPAC name of 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline?
The IUPAC name of 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline (CID 139364038) is 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline.
What is the SMILES notation for 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline?
The canonical SMILES for 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline is c1ccc2cc3nc(-c4cc(-c5ccncc5)cc(-c5ccc6cc7ccccc7cc6n5)c4)ccc3cc2c1.
What is the InChIKey of 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline?
The InChIKey is VOJZUEGJWWJORR-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H23N3/c1-3-7-27-22-36-29(17-25(27)5-1)9-11-34(39-36)32-19-31(24-13-15-38-16-14-24)20-33(21-32)35-12-10-30-18-26-6-2-4-8-28(26)23-37(30)40-35/h1-23H.
What are the key properties of 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline?
2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline has a molecular weight of 509.61 g/mol, XLogP of 9.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzo[g]quinolin-2-yl-5-pyridin-4-ylphenyl)benzo[g]quinoline is sourced from PubChem (CID 139364038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).