7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole

C29H18N2O — CID 164802716

IUPAC7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)nc1
InChIInChI=1S/C29H18N2O/c1-3-13-26-21(10-1)23-17-24-22-11-2-4-14-28(22)32-29(24)18-27(23)31(26)20-9-7-8-19(16-20)25-12-5-6-15-30-25/h1-18H
InChIKeyIYVBRUOBFVTIOB-UHFFFAOYSA-N
MW410.48 g/mol
LogP7.75
Rot. Bonds2

About 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole

7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole (PubChem CID 164802716) has the molecular formula C29H18N2O and a molecular weight of 410.48 g/mol. Its IUPAC name is 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole
PubChem CID164802716
Molecular FormulaC29H18N2O
Molecular Weight410.48 g/mol
Exact Mass410.14
IUPAC Name7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)nc1
InChIInChI=1S/C29H18N2O/c1-3-13-26-21(10-1)23-17-24-22-11-2-4-14-28(22)32-29(24)18-27(23)31(26)20-9-7-8-19(16-20)25-12-5-6-15-30-25/h1-18H
InChIKeyIYVBRUOBFVTIOB-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

2-[3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]phenyl]pyridine-4-carbonitrile
CID 146543626
25-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-15-phenyl-11-oxa-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17,19,21,23,26-dodecaene
CID 140957385
7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole
CID 171612106
7-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole
CID 90324752
3-dibenzothiophen-2-yl-9-[3-[8-(3-pyridin-2-ylphenyl)dibenzofuran-2-yl]phenyl]carbazole
CID 71278025
2-[3-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]phenyl]pyridine-4-carbonitrile
CID 146543126
7-[4-[3-(3,5-diphenylphenyl)phenyl]-6-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]pyrimidin-2-yl]-[1]benzofuro[2,3-b]carbazole
CID 134237088
9-(3-carbazol-9-ylphenyl)-3-(3-pyridin-2-ylphenyl)carbazole
CID 71277989
7-[3-(3-methyl-2-phenylbenzimidazol-5-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 90324751
9,14-bis(3-pyridin-2-ylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 118504672
5-dibenzofuran-3-yl-7-[3-(3-phenylphenyl)phenyl]indolo[2,3-b]carbazole
CID 171414735
7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-(2-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole
CID 155006709

Frequently Asked Questions

What is the IUPAC name of 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole (CID 164802716) is 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole is c1ccc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)nc1.
What is the InChIKey of 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole?
The InChIKey is IYVBRUOBFVTIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H18N2O/c1-3-13-26-21(10-1)23-17-24-22-11-2-4-14-28(22)32-29(24)18-27(23)31(26)20-9-7-8-19(16-20)25-12-5-6-15-30-25/h1-18H.
What are the key properties of 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole?
7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole 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 7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 164802716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).