12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole

C53H33N3O — CID 121385487

IUPAC12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc7oc8ccccc8c7c6)c45)c3)cc2)cc1
InChIInChI=1S/C53H33N3O/c1-3-13-34(14-4-1)35-23-25-36(26-24-35)38-31-45(37-15-5-2-6-16-37)54-51(32-38)56-47-21-11-8-19-43(47)52-48(56)29-28-42-40-17-7-10-20-46(40)55(53(42)52)39-27-30-50-44(33-39)41-18-9-12-22-49(41)57-50/h1-33H
InChIKeyANLOMPJSHXWAEL-UHFFFAOYSA-N
MW727.87 g/mol
LogP14.18
Rot. Bonds5

About 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole

12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole (PubChem CID 121385487) has the molecular formula C53H33N3O and a molecular weight of 727.87 g/mol. Its IUPAC name is 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole
PubChem CID121385487
Molecular FormulaC53H33N3O
Molecular Weight727.87 g/mol
Exact Mass727.26
IUPAC Name12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc7oc8ccccc8c7c6)c45)c3)cc2)cc1
InChIInChI=1S/C53H33N3O/c1-3-13-34(14-4-1)35-23-25-36(26-24-35)38-31-45(37-15-5-2-6-16-37)54-51(32-38)56-47-21-11-8-19-43(47)52-48(56)29-28-42-40-17-7-10-20-46(40)55(53(42)52)39-27-30-50-44(33-39)41-18-9-12-22-49(41)57-50/h1-33H
InChIKeyANLOMPJSHXWAEL-UHFFFAOYSA-N
XLogP14.18
TPSA35.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500727.87
LogP ≤ 514.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

12-(4-carbazol-9-ylphenyl)-5-(4,6-diphenyl-2-pyridinyl)indolo[3,2-c]carbazole
CID 144650064
12-dibenzofuran-2-yl-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 163700915
12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598858
5-[4-(6-dibenzofuran-2-yl-2-phenylpyrimidin-4-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 90085731
5-(9-dibenzofuran-2-ylcarbazol-3-yl)-12-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 170268239
2-(5-dibenzofuran-2-ylindolo[3,2-c]carbazol-12-yl)-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]aniline
CID 139303970
3-(9-dibenzofuran-2-ylcarbazol-2-yl)-9-(3,5-diphenylphenyl)carbazole;3-(9-dibenzofuran-2-ylcarbazol-2-yl)-9-phenylcarbazole;3-(9-dibenzofuran-2-ylcarbazol-2-yl)-9-(3-phenylphenyl)carbazole;3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-2-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-2-yl]-9-(3-phenylphenyl)carbazole;2-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-phenyl-5-pyridin-4-ylphenyl)carbazole
CID 165023898
11-[2-dibenzofuran-1-yl-6-(4-phenylphenyl)pyrimidin-4-yl]-[1]benzofuro[3,2-b]carbazole;11-(2-dibenzofuran-2-yl-6-phenylpyrimidin-4-yl)-[1]benzofuro[3,2-b]carbazole;5-(2-dibenzofuran-3-yl-6-phenylpyrimidin-4-yl)-12-phenylindolo[3,2-c]carbazole
CID 159307474
5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 118502718
12-dibenzofuran-2-yl-5-naphthalen-2-ylindolo[3,2-c]carbazole
CID 167030159
2-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-9-dibenzofuran-2-ylcarbazole
CID 139555285
5-[6-(4,6-diphenyl-2-pyridinyl)naphthalen-2-yl]-12-phenylindolo[3,2-c]carbazole
CID 155241006

Frequently Asked Questions

What is the IUPAC name of 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole?
The IUPAC name of 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole (CID 121385487) is 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole.
What is the SMILES notation for 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole?
The canonical SMILES for 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole is c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc7oc8ccccc8c7c6)c45)c3)cc2)cc1.
What is the InChIKey of 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole?
The InChIKey is ANLOMPJSHXWAEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H33N3O/c1-3-13-34(14-4-1)35-23-25-36(26-24-35)38-31-45(37-15-5-2-6-16-37)54-51(32-38)56-47-21-11-8-19-43(47)52-48(56)29-28-42-40-17-7-10-20-46(40)55(53(42)52)39-27-30-50-44(33-39)41-18-9-12-22-49(41)57-50/h1-33H.
What are the key properties of 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole?
12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole has a molecular weight of 727.87 g/mol, XLogP of 14.18, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 12-dibenzofuran-2-yl-5-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole is sourced from PubChem (CID 121385487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).