7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline

C37H24N4 — CID 145180542

IUPAC7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline
SMILESc1cncc(-c2cccc(-c3ccc(-c4ccc(-c5c6ccccc6n6c5cnc5ccccc56)cc4)cc3)n2)c1
InChIInChI=1S/C37H24N4/c1-3-12-34-30(8-1)37(36-24-39-33-9-2-4-13-35(33)41(34)36)28-20-16-26(17-21-28)25-14-18-27(19-15-25)31-10-5-11-32(40-31)29-7-6-22-38-23-29/h1-24H
InChIKeyWPJXITCYRLIRBC-UHFFFAOYSA-N
MW524.63 g/mol
LogP9.10
Rot. Bonds4

About 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline

7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline (PubChem CID 145180542) has the molecular formula C37H24N4 and a molecular weight of 524.63 g/mol. Its IUPAC name is 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline
PubChem CID145180542
Molecular FormulaC37H24N4
Molecular Weight524.63 g/mol
Exact Mass524.20
IUPAC Name7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline
SMILESc1cncc(-c2cccc(-c3ccc(-c4ccc(-c5c6ccccc6n6c5cnc5ccccc56)cc4)cc3)n2)c1
InChIInChI=1S/C37H24N4/c1-3-12-34-30(8-1)37(36-24-39-33-9-2-4-13-35(33)41(34)36)28-20-16-26(17-21-28)25-14-18-27(19-15-25)31-10-5-11-32(40-31)29-7-6-22-38-23-29/h1-24H
InChIKeyWPJXITCYRLIRBC-UHFFFAOYSA-N
XLogP9.10
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.63
LogP ≤ 59.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline with MolForge

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Related Compounds

7-[3-[2,6-bis(4-pyridin-4-ylphenyl)-4-pyridinyl]phenyl]indolo[1,2-a]quinoxaline
CID 145180348
7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline
CID 145180155
7-[3-(4-diphenylphosphorylphenyl)phenyl]indolo[1,2-a]quinoxaline
CID 145179941
7-[4-(2-naphthalen-1-yl-4,6-diphenylpyrimidin-5-yl)phenyl]indolo[1,2-a]quinoxaline
CID 145180495
7-[4-[6-(1,10-phenanthrolin-5-yl)naphthalen-2-yl]phenyl]indolo[1,2-a]quinoxaline
CID 145180557
9-[4-[6-[4-(2,5-dipyridin-3-ylpyrrol-1-yl)phenyl]-2-pyridinyl]phenyl]carbazole
CID 58489429
2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-6-pyridin-3-ylpyridine
CID 89001174
2,6-dipyridin-3-ylpyridine
CID 13349632
2-[4-[10-(4-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine
CID 58568854
2-[3-(10-phenylanthracen-9-yl)naphthalen-1-yl]-6-pyridin-3-ylpyridine
CID 118563958
9-(2,6-dipyridin-3-yl-4-pyridinyl)carbazole
CID 135264911
2-[3-(10-phenylanthracen-9-yl)phenyl]-4-(4-pyridin-3-ylphenyl)pyrimidine
CID 129084345

Frequently Asked Questions

What is the IUPAC name of 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline?
The IUPAC name of 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline (CID 145180542) is 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline.
What is the SMILES notation for 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline?
The canonical SMILES for 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline is c1cncc(-c2cccc(-c3ccc(-c4ccc(-c5c6ccccc6n6c5cnc5ccccc56)cc4)cc3)n2)c1.
What is the InChIKey of 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline?
The InChIKey is WPJXITCYRLIRBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24N4/c1-3-12-34-30(8-1)37(36-24-39-33-9-2-4-13-35(33)41(34)36)28-20-16-26(17-21-28)25-14-18-27(19-15-25)31-10-5-11-32(40-31)29-7-6-22-38-23-29/h1-24H.
What are the key properties of 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline?
7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline has a molecular weight of 524.63 g/mol, XLogP of 9.10, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline is sourced from PubChem (CID 145180542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).