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

C36H21NO2 — CID 171612106

IUPAC7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole
SMILESc1cc(-c2cccc3oc4ccccc4c23)cc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)c1
InChIInChI=1S/C36H21NO2/c1-4-15-30-25(11-1)28-20-29-26-12-2-5-16-32(26)39-35(29)21-31(28)37(30)23-10-7-9-22(19-23)24-14-8-18-34-36(24)27-13-3-6-17-33(27)38-34/h1-21H
InChIKeyZHBVXWVKMTTYSM-UHFFFAOYSA-N
MW499.57 g/mol
LogP10.25
Rot. Bonds2

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

7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole (PubChem CID 171612106) has the molecular formula C36H21NO2 and a molecular weight of 499.57 g/mol. Its IUPAC name is 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole
PubChem CID171612106
Molecular FormulaC36H21NO2
Molecular Weight499.57 g/mol
Exact Mass499.16
IUPAC Name7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole
SMILESc1cc(-c2cccc3oc4ccccc4c23)cc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)c1
InChIInChI=1S/C36H21NO2/c1-4-15-30-25(11-1)28-20-29-26-12-2-5-16-32(26)39-35(29)21-31(28)37(30)23-10-7-9-22(19-23)24-14-8-18-34-36(24)27-13-3-6-17-33(27)38-34/h1-21H
InChIKeyZHBVXWVKMTTYSM-UHFFFAOYSA-N
XLogP10.25
TPSA31.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500499.57
LogP ≤ 510.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

10-(8-carbazol-9-yldibenzofuran-1-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 134516179
22-(3-fluoranthen-3-ylphenyl)-10-oxa-22-azahexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4,6,8,12,14,16,18,20,23-undecaene
CID 118581027
9-[3-[4-(8-dibenzofuran-1-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 162780137
7-[3-(4-phenyl-[1]benzofuro[2,3-d]pyrimidin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 130333597
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-[2-[3-[3-(3,5-diphenyl-1,2,4-triazol-4-yl)carbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole
CID 146227084
7-(3-pyridin-2-ylphenyl)-[1]benzofuro[2,3-b]carbazole
CID 164802716
9-(3-dibenzofuran-1-ylphenyl)-3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 118149426
2-dibenzofuran-1-yl-9-dibenzofuran-2-yl-7-phenylcarbazole
CID 130232982
5-dibenzofuran-3-yl-7-[3-(3-phenylphenyl)phenyl]indolo[2,3-b]carbazole
CID 171414735
3-dibenzofuran-1-yl-9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole;3-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 165052317
2-dibenzofuran-1-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 161252356

Frequently Asked Questions

What is the IUPAC name of 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole (CID 171612106) is 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole is c1cc(-c2cccc3oc4ccccc4c23)cc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)c1.
What is the InChIKey of 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole?
The InChIKey is ZHBVXWVKMTTYSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H21NO2/c1-4-15-30-25(11-1)28-20-29-26-12-2-5-16-32(26)39-35(29)21-31(28)37(30)23-10-7-9-22(19-23)24-14-8-18-34-36(24)27-13-3-6-17-33(27)38-34/h1-21H.
What are the key properties of 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole?
7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole has a molecular weight of 499.57 g/mol, XLogP of 10.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-dibenzofuran-1-ylphenyl)-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 171612106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).