5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole

C36H21NO2 — CID 90225205

IUPAC5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole
SMILESc1ccc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)cc3)cccc12
InChIInChI=1S/C36H21NO2/c1-4-13-30-29(10-1)34-31(21-20-28-26-9-3-6-15-33(26)39-36(28)34)37(30)23-18-16-22(17-19-23)24-11-7-12-27-25-8-2-5-14-32(25)38-35(24)27/h1-21H
InChIKeyOGFGIPIHCZXCLK-UHFFFAOYSA-N
MW499.57 g/mol
LogP10.25
Rot. Bonds2

About 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole

5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole (PubChem CID 90225205) has the molecular formula C36H21NO2 and a molecular weight of 499.57 g/mol. Its IUPAC name is 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole
PubChem CID90225205
Molecular FormulaC36H21NO2
Molecular Weight499.57 g/mol
Exact Mass499.16
IUPAC Name5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole
SMILESc1ccc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)cc3)cccc12
InChIInChI=1S/C36H21NO2/c1-4-13-30-29(10-1)34-31(21-20-28-26-9-3-6-15-33(26)39-36(28)34)37(30)23-18-16-22(17-19-23)24-11-7-12-27-25-8-2-5-14-32(25)38-35(24)27/h1-21H
InChIKeyOGFGIPIHCZXCLK-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

9-(4-dibenzofuran-4-ylphenyl)-14-(4-phenylphenyl)-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 126580156
9-(4-dibenzofuran-4-ylphenyl)-14-[4-(4-phenylphenyl)phenyl]-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 126580159
5-[4-[4-[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 149479676
14-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 90191516
4-[14-(4-dibenzofuran-4-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-nonaen-9-yl]benzenethiol
CID 144512001
9-(4-carbazol-9-ylphenyl)-14-phenyl-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;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-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;9,14-diphenyl-5-(9-phenylcarbazol-3-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 159165938
N,N-bis(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylaniline
CID 58510642
5-[4-(2-dibenzofuran-4-yl-6-phenyl-4-pyridinyl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 118154439
15-dibenzofuran-4-yl-24-phenyl-4-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),3(11),5,7,9,12,17(25),18,20,22,26-dodecaene;15-(3-dibenzofuran-4-ylphenyl)-24-phenyl-4-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),3(11),5,7,9,12,17(25),18,20,22,26-dodecaene;15-(4-dibenzofuran-4-ylphenyl)-24-phenyl-4-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),3(11),5,7,9,12,17(25),18,20,22,26-dodecaene
CID 160912850
9-(4-dibenzofuran-4-ylphenyl)-14-(1,3,5-triazin-2-yl)-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 118502038
12-(4-dibenzofuran-4-ylphenyl)-5,9-diphenylindolo[3,2-c]carbazole
CID 126580189
3-(4-dibenzofuran-4-ylphenyl)-24-phenyl-3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene
CID 118488562

Frequently Asked Questions

What is the IUPAC name of 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole (CID 90225205) is 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole is c1ccc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)cc3)cccc12.
What is the InChIKey of 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole?
The InChIKey is OGFGIPIHCZXCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H21NO2/c1-4-13-30-29(10-1)34-31(21-20-28-26-9-3-6-15-33(26)39-36(28)34)37(30)23-18-16-22(17-19-23)24-11-7-12-27-25-8-2-5-14-32(25)38-35(24)27/h1-21H.
What are the key properties of 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole?
5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]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 5-(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 90225205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).