2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline

C27H17NO — CID 159518374

IUPAC2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline
SMILESc1ccc(-c2ccc(-c3ccc4oc5nc6ccccc6cc5c4c3)cc2)cc1
InChIInChI=1S/C27H17NO/c1-2-6-18(7-3-1)19-10-12-20(13-11-19)21-14-15-26-23(16-21)24-17-22-8-4-5-9-25(22)28-27(24)29-26/h1-17H
InChIKeyQZDQMBLFVCUYGG-UHFFFAOYSA-N
MW371.44 g/mol
LogP7.47
Rot. Bonds2

About 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline

2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline (PubChem CID 159518374) has the molecular formula C27H17NO and a molecular weight of 371.44 g/mol. Its IUPAC name is 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline.

Molecular Properties

Compound Name2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline
PubChem CID159518374
Molecular FormulaC27H17NO
Molecular Weight371.44 g/mol
Exact Mass371.13
IUPAC Name2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline
SMILESc1ccc(-c2ccc(-c3ccc4oc5nc6ccccc6cc5c4c3)cc2)cc1
InChIInChI=1S/C27H17NO/c1-2-6-18(7-3-1)19-10-12-20(13-11-19)21-14-15-26-23(16-21)24-17-22-8-4-5-9-25(22)28-27(24)29-26/h1-17H
InChIKeyQZDQMBLFVCUYGG-UHFFFAOYSA-N
XLogP7.47
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.44
LogP ≤ 57.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-([1]benzofuro[2,3-b]quinolin-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 121340920
2-[3-([1]benzofuro[2,3-b]quinolin-2-yl)-5-[6-phenyl-2-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]quinoline
CID 121340985
2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline
CID 121340944
2,8-bis(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran;2,8-bis(6-phenylnaphthalen-2-yl)dibenzofuran;2,8-bis(7-phenylnaphthalen-2-yl)dibenzofuran;2-[7-(cyclodecapentaenyl)naphthalen-2-yl]-8-(7-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran
CID 158865776
2-phenyl-3-[8-(3-phenylquinoxalin-2-yl)dibenzofuran-2-yl]quinoxaline
CID 3123808
2-[4-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran
CID 90433351
9,27-diphenyl-13,17,21,31-tetraoxanonacyclo[18.14.0.03,18.04,16.06,14.07,12.022,34.024,32.025,30]tetratriaconta-1(20),2,4(16),5,7(12),8,10,14,18,22,24(32),25(30),26,28,33-pentadecaene
CID 58004021
N,4-diphenyl-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]aniline;4-phenyl-N,N-bis(4-phenylphenyl)aniline;4-phenyl-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(8-phenyldibenzofuran-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 158000824
8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine
CID 59470035
2-(3-phenanthren-9-ylphenyl)-[1]benzofuro[3,2-b]quinoxaline
CID 134273405
2-phenyl-4-(4-phenylphenyl)-6-[7-(4-phenylphenyl)dibenzofuran-2-yl]-1,3,5-triazine
CID 155773120
2,4-diphenyl-6-[7-(8-phenyldibenzofuran-3-yl)dibenzofuran-3-yl]-1,3,5-triazine
CID 166009504

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline?
The IUPAC name of 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline (CID 159518374) is 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline.
What is the SMILES notation for 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline?
The canonical SMILES for 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline is c1ccc(-c2ccc(-c3ccc4oc5nc6ccccc6cc5c4c3)cc2)cc1.
What is the InChIKey of 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline?
The InChIKey is QZDQMBLFVCUYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H17NO/c1-2-6-18(7-3-1)19-10-12-20(13-11-19)21-14-15-26-23(16-21)24-17-22-8-4-5-9-25(22)28-27(24)29-26/h1-17H.
What are the key properties of 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline?
2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline has a molecular weight of 371.44 g/mol, XLogP of 7.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline is sourced from PubChem (CID 159518374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).