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

C48H30N2O — CID 122598858

IUPAC12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccc(-c3cccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc7oc8ccccc8c7c6)c45)c3)cc2)cc1
InChIInChI=1S/C48H30N2O/c1-2-11-31(12-3-1)32-21-23-33(24-22-32)34-13-10-14-35(29-34)49-43-19-8-5-17-40(43)47-44(49)27-26-39-37-15-4-7-18-42(37)50(48(39)47)36-25-28-46-41(30-36)38-16-6-9-20-45(38)51-46/h1-30H
InChIKeyVYAQEJBIGKTCHE-UHFFFAOYSA-N
MW650.78 g/mol
LogP13.11
Rot. Bonds4

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

12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole (PubChem CID 122598858) has the molecular formula C48H30N2O and a molecular weight of 650.78 g/mol. Its IUPAC name is 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
PubChem CID122598858
Molecular FormulaC48H30N2O
Molecular Weight650.78 g/mol
Exact Mass650.24
IUPAC Name12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccc(-c3cccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc7oc8ccccc8c7c6)c45)c3)cc2)cc1
InChIInChI=1S/C48H30N2O/c1-2-11-31(12-3-1)32-21-23-33(24-22-32)34-13-10-14-35(29-34)49-43-19-8-5-17-40(43)47-44(49)27-26-39-37-15-4-7-18-42(37)50(48(39)47)36-25-28-46-41(30-36)38-16-6-9-20-45(38)51-46/h1-30H
InChIKeyVYAQEJBIGKTCHE-UHFFFAOYSA-N
XLogP13.11
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500650.78
LogP ≤ 513.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(9-dibenzofuran-2-ylcarbazol-3-yl)-12-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 170268239
12-dibenzofuran-2-yl-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 163700915
9-dibenzofuran-2-yl-14-[3-(3-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 166961355
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole
CID 90350922
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-6-phenyl-9-(3-phenylphenyl)carbazole
CID 170072680
12-(3-phenylphenyl)-5-[4-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598833
5-(3-phenylphenyl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 126656172
12-[3-(4-carbazol-9-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 134168746
5,12-bis[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598848
12-(3-dibenzofuran-2-ylphenyl)-[1]benzofuro[3,2-a]carbazole
CID 163673280
12-(4-carbazol-9-ylphenyl)-5-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 134168741
6-phenyl-2-(5-phenylindolo[3,2-c]carbazol-12-yl)xanthen-9-one
CID 146175933

Frequently Asked Questions

What is the IUPAC name of 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole?
The IUPAC name of 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole (CID 122598858) is 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole.
What is the SMILES notation for 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole?
The canonical SMILES for 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole is c1ccc(-c2ccc(-c3cccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccc7oc8ccccc8c7c6)c45)c3)cc2)cc1.
What is the InChIKey of 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole?
The InChIKey is VYAQEJBIGKTCHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O/c1-2-11-31(12-3-1)32-21-23-33(24-22-32)34-13-10-14-35(29-34)49-43-19-8-5-17-40(43)47-44(49)27-26-39-37-15-4-7-18-42(37)50(48(39)47)36-25-28-46-41(30-36)38-16-6-9-20-45(38)51-46/h1-30H.
What are the key properties of 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole?
12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole has a molecular weight of 650.78 g/mol, XLogP of 13.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole is sourced from PubChem (CID 122598858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).