5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole

C42H26N2O — CID 122594976

IUPAC5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc7c(c6)oc6ccccc67)c5cc43)cc2)cc1
InChIInChI=1S/C42H26N2O/c1-2-10-27(11-3-1)28-18-20-29(21-19-28)43-37-15-7-4-12-31(37)35-25-36-32-13-5-8-16-38(32)44(40(36)26-39(35)43)30-22-23-34-33-14-6-9-17-41(33)45-42(34)24-30/h1-26H
InChIKeyKCCJCQWANDQROJ-UHFFFAOYSA-N
MW574.68 g/mol
LogP11.45
Rot. Bonds3

About 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole

5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole (PubChem CID 122594976) has the molecular formula C42H26N2O and a molecular weight of 574.68 g/mol. Its IUPAC name is 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole.

Molecular Properties

Compound Name5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole
PubChem CID122594976
Molecular FormulaC42H26N2O
Molecular Weight574.68 g/mol
Exact Mass574.20
IUPAC Name5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc7c(c6)oc6ccccc67)c5cc43)cc2)cc1
InChIInChI=1S/C42H26N2O/c1-2-10-27(11-3-1)28-18-20-29(21-19-28)43-37-15-7-4-12-31(37)35-25-36-32-13-5-8-16-38(32)44(40(36)26-39(35)43)30-22-23-34-33-14-6-9-17-41(33)45-42(34)24-30/h1-26H
InChIKeyKCCJCQWANDQROJ-UHFFFAOYSA-N
XLogP11.45
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.68
LogP ≤ 511.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-dibenzofuran-3-yl-7-[4-(3-phenylphenyl)phenyl]indolo[2,3-b]carbazole
CID 164847658
5-dibenzofuran-3-yl-7-(3-phenylphenyl)indolo[2,3-b]carbazole;5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole;11-dibenzofuran-3-yl-5-(3-phenylphenyl)indolo[3,2-b]carbazole
CID 163829612
3-[4-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]-9-(4-phenylphenyl)carbazole
CID 146187490
5-dibenzofuran-3-yl-7-[3-(3-phenylphenyl)phenyl]indolo[2,3-b]carbazole
CID 171414735
15-(9-dibenzofuran-3-ylcarbazol-3-yl)-11,19-diphenyl-11,15,19-triazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene
CID 174349854
10-dibenzofuran-3-yl-23-(4-phenylphenyl)-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(14),2,4,6,8(13),9,11,15,17,19,21,24-dodecaene
CID 121324824
3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-phenylcarbazole
CID 70658931
7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole
CID 167192760
7-[4-(8-phenyldibenzofuran-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 171612092
3,6-bis(9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594553
3-[9-(10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaen-7-yl)carbazol-3-yl]-9-phenylcarbazole
CID 142497222
3-dibenzofuran-3-yl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 129065102

Frequently Asked Questions

What is the IUPAC name of 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole?
The IUPAC name of 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole (CID 122594976) is 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole.
What is the SMILES notation for 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole?
The canonical SMILES for 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc7c(c6)oc6ccccc67)c5cc43)cc2)cc1.
What is the InChIKey of 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole?
The InChIKey is KCCJCQWANDQROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H26N2O/c1-2-10-27(11-3-1)28-18-20-29(21-19-28)43-37-15-7-4-12-31(37)35-25-36-32-13-5-8-16-38(32)44(40(36)26-39(35)43)30-22-23-34-33-14-6-9-17-41(33)45-42(34)24-30/h1-26H.
What are the key properties of 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole?
5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole has a molecular weight of 574.68 g/mol, XLogP of 11.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole is sourced from PubChem (CID 122594976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).