4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole

C38H23N3O — CID 129290215

IUPAC4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2nc3ccccc3nc2-n2c3ccccc3c3cc4c(cc32)oc2c(-c3ccccc3)cccc24)cc1
InChIInChI=1S/C38H23N3O/c1-3-12-24(13-4-1)26-17-11-18-28-30-22-29-27-16-7-10-21-33(27)41(34(29)23-35(30)42-37(26)28)38-36(25-14-5-2-6-15-25)39-31-19-8-9-20-32(31)40-38/h1-23H
InChIKeyAKTYYGPXFDCQCY-UHFFFAOYSA-N
MW537.62 g/mol
LogP9.96
Rot. Bonds3

About 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole

4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole (PubChem CID 129290215) has the molecular formula C38H23N3O and a molecular weight of 537.62 g/mol. Its IUPAC name is 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole
PubChem CID129290215
Molecular FormulaC38H23N3O
Molecular Weight537.62 g/mol
Exact Mass537.18
IUPAC Name4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2nc3ccccc3nc2-n2c3ccccc3c3cc4c(cc32)oc2c(-c3ccccc3)cccc24)cc1
InChIInChI=1S/C38H23N3O/c1-3-12-24(13-4-1)26-17-11-18-28-30-22-29-27-16-7-10-21-33(27)41(34(29)23-35(30)42-37(26)28)38-36(25-14-5-2-6-15-25)39-31-19-8-9-20-32(31)40-38/h1-23H
InChIKeyAKTYYGPXFDCQCY-UHFFFAOYSA-N
XLogP9.96
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500537.62
LogP ≤ 59.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

16-[3-(2-phenylphenyl)quinoxalin-2-yl]-12-oxa-16-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 155020559
4-dibenzofuran-4-yl-5-(3-phenylquinoxalin-2-yl)benzo[b]carbazole
CID 142569867
2-dibenzofuran-4-yl-5-[3-(5-phenylbenzo[b]carbazol-8-yl)quinoxalin-2-yl]benzo[b]carbazole
CID 147851338
7-[3-(4-phenylphenyl)phenyl]-4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-b]carbazole
CID 163950342
7-(3-phenylphenyl)-4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-b]carbazole
CID 163950340
5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole
CID 161274836
5-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-11,11-dimethylindeno[1,2-b]carbazole;11,11-dimethyl-5-(3-phenylquinoxalin-2-yl)indeno[1,2-b]carbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11-dimethyl-2-phenylindeno[1,2-b]carbazole
CID 165082751
12-(3-phenylquinoxalin-2-yl)-16-oxa-12-azahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 155020585
5-[3-(4-quinolin-8-ylphenyl)quinoxalin-2-yl]benzo[b]carbazole
CID 139361992
5-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-7,7-diphenylindeno[2,1-b]carbazole;7,7-diphenyl-5-(3-phenylquinoxalin-2-yl)indeno[2,1-b]carbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole
CID 158224995
4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole
CID 163452922
4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]-7-(3-phenylphenyl)-[1]benzofuro[2,3-b]carbazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-(4-phenylphenyl)-[1]benzofuro[2,3-b]carbazole;7-(4-phenylphenyl)-4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-b]carbazole;7-phenyl-4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-b]carbazole;7-phenyl-4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-b]carbazole
CID 163529278

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole (CID 129290215) is 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole is c1ccc(-c2nc3ccccc3nc2-n2c3ccccc3c3cc4c(cc32)oc2c(-c3ccccc3)cccc24)cc1.
What is the InChIKey of 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole?
The InChIKey is AKTYYGPXFDCQCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H23N3O/c1-3-12-24(13-4-1)26-17-11-18-28-30-22-29-27-16-7-10-21-33(27)41(34(29)23-35(30)42-37(26)28)38-36(25-14-5-2-6-15-25)39-31-19-8-9-20-32(31)40-38/h1-23H.
What are the key properties of 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole?
4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole has a molecular weight of 537.62 g/mol, XLogP of 9.96, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 129290215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).