6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine

C29H18N2O — CID 122692971

IUPAC6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine
SMILESc1cnc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cccc12
InChIInChI=1S/C29H18N2O/c1-3-11-25-22(7-1)23-8-2-4-12-26(23)31(25)20-16-14-19(15-17-20)21-9-5-10-24-28-27(32-29(21)24)13-6-18-30-28/h1-18H
InChIKeyCZJLBNCRCVCOSR-UHFFFAOYSA-N
MW410.48 g/mol
LogP7.75
Rot. Bonds2

About 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine

6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine (PubChem CID 122692971) has the molecular formula C29H18N2O and a molecular weight of 410.48 g/mol. Its IUPAC name is 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine.

Molecular Properties

Compound Name6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine
PubChem CID122692971
Molecular FormulaC29H18N2O
Molecular Weight410.48 g/mol
Exact Mass410.14
IUPAC Name6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine
SMILESc1cnc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cccc12
InChIInChI=1S/C29H18N2O/c1-3-11-25-22(7-1)23-8-2-4-12-26(23)31(25)20-16-14-19(15-17-20)21-9-5-10-24-28-27(32-29(21)24)13-6-18-30-28/h1-18H
InChIKeyCZJLBNCRCVCOSR-UHFFFAOYSA-N
XLogP7.75
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.48
LogP ≤ 57.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine
CID 122692968
8-[2-(4-carbazol-9-ylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridine
CID 122692983
6-[4-[3,6-bis(4-dibenzofuran-4-ylphenyl)carbazol-9-yl]phenyl]-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 121449359
4-([1]benzofuro[3,2-b]pyridin-9-yl)-N-(4-carbazol-9-ylphenyl)-N-phenylaniline
CID 170177041
2-(4-carbazol-9-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)-1,10-phenanthroline
CID 90049874
N,N-bis(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylaniline
CID 58510642
8-[4-(4-carbazol-9-ylphenyl)phenyl]-[1]benzofuro[3,2-b]pyridine
CID 122693136
6-(3-carbazol-9-ylphenyl)-8-phenyl-[1]benzofuro[3,2-b]pyridine
CID 122692992
9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
CID 129128081
3-dibenzofuran-2-yl-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 121449395
5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole
CID 90225205
12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole
CID 71098785

Frequently Asked Questions

What is the IUPAC name of 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine?
The IUPAC name of 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine (CID 122692971) is 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine.
What is the SMILES notation for 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine?
The canonical SMILES for 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine is c1cnc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cccc12.
What is the InChIKey of 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine?
The InChIKey is CZJLBNCRCVCOSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H18N2O/c1-3-11-25-22(7-1)23-8-2-4-12-26(23)31(25)20-16-14-19(15-17-20)21-9-5-10-24-28-27(32-29(21)24)13-6-18-30-28/h1-18H.
What are the key properties of 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine?
6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine has a molecular weight of 410.48 g/mol, XLogP of 7.75, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]pyridine is sourced from PubChem (CID 122692971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).