5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole

C132H80N4O4S — CID 159515126

IUPAC5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole
SMILESc1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)c3c2)cc1.c1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)c3c2)cc1.c1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)c3c2)cc1
InChIInChI=1S/C48H30N2O.C42H25NO2.C42H25NOS/c1-3-11-31(12-4-1)34-21-25-40-45(30-34)50(44-28-26-39-38-16-8-10-18-46(38)51-48(39)47(40)44)36-23-19-32(20-24-36)33-22-27-43-41(29-33)37-15-7-9-17-42(37)49(43)35-13-5-2-6-14-35;1-2-9-26(10-3-1)28-19-22-35-37(25-28)43(36-24-23-34-32-12-5-7-16-39(32)45-42(34)40(35)36)29-20-17-27(18-21-29)30-13-8-14-33-31-11-4-6-15-38(31)44-41(30)33;1-2-9-26(10-3-1)28-19-22-35-37(25-28)43(36-24-23-33-31-11-4-6-15-38(31)44-41(33)40(35)36)29-20-17-27(18-21-29)30-13-8-14-34-32-12-5-7-16-39(32)45-42(30)34/h1-30H;2*1-25H
InChIKeyMBCAJCSWMLUAHG-UHFFFAOYSA-N
MW1818.18 g/mol
LogP37.42
Rot. Bonds10

About 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole

5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole (PubChem CID 159515126) has the molecular formula C132H80N4O4S and a molecular weight of 1818.18 g/mol. Its IUPAC name is 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole
PubChem CID159515126
Molecular FormulaC132H80N4O4S
Molecular Weight1818.18 g/mol
Exact Mass1816.59
IUPAC Name5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole
SMILESc1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)c3c2)cc1.c1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)c3c2)cc1.c1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)c3c2)cc1
InChIInChI=1S/C48H30N2O.C42H25NO2.C42H25NOS/c1-3-11-31(12-4-1)34-21-25-40-45(30-34)50(44-28-26-39-38-16-8-10-18-46(38)51-48(39)47(40)44)36-23-19-32(20-24-36)33-22-27-43-41(29-33)37-15-7-9-17-42(37)49(43)35-13-5-2-6-14-35;1-2-9-26(10-3-1)28-19-22-35-37(25-28)43(36-24-23-34-32-12-5-7-16-39(32)45-42(34)40(35)36)29-20-17-27(18-21-29)30-13-8-14-33-31-11-4-6-15-38(31)44-41(30)33;1-2-9-26(10-3-1)28-19-22-35-37(25-28)43(36-24-23-33-31-11-4-6-15-38(31)44-41(33)40(35)36)29-20-17-27(18-21-29)30-13-8-14-34-32-12-5-7-16-39(32)45-42(30)34/h1-30H;2*1-25H
InChIKeyMBCAJCSWMLUAHG-UHFFFAOYSA-N
XLogP37.42
TPSA72.28 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds10
Heavy Atoms141
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001818.18
LogP ≤ 537.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole with MolForge

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Related Compounds

2-dibenzofuran-4-yl-7-(4-dibenzothiophen-4-ylphenyl)-5-phenylindolo[2,3-b]carbazole
CID 126579968
2-dibenzofuran-4-yl-6-[3-methyl-5-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzothiophen-4-yl-6-[3-methyl-5-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole
CID 165084340
2-dibenzofuran-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;2-dibenzofuran-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;3-dibenzofuran-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;2-dibenzothiophen-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzothiophen-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzothiophen-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 157382903
2-dibenzofuran-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzofuran-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;2-dibenzothiophen-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzothiophen-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 159942407
5-dibenzofuran-4-yl-2-phenyl-[1]benzofuro[3,2-c]carbazole;5-dibenzothiophen-4-yl-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(6,9-diphenylcarbazol-3-yl)-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-(9-phenylcarbazol-2-yl)-[1]benzofuro[3,2-c]carbazole
CID 158788066
9-dibenzofuran-4-yl-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;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole
CID 160649083
2-carbazol-9-yl-9-[3-(3-dibenzofuran-4-ylphenyl)phenyl]carbazole;2-carbazol-9-yl-9-[4-(3-dibenzofuran-4-ylphenyl)phenyl]carbazole;2-carbazol-9-yl-9-[3-(4-dibenzothiophen-4-ylphenyl)phenyl]carbazole;2-carbazol-9-yl-9-[4-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazole
CID 159901697
N-(4-dibenzofuran-4-ylphenyl)-5-phenyl-N-(4-phenylphenyl)-[1]benzofuro[2,3-g]carbazol-3-amine;N-(4-dibenzofuran-4-ylphenyl)-5-phenyl-N-(4-phenylphenyl)-[1]benzothiolo[2,3-g]carbazol-3-amine;N-(4-dibenzothiophen-4-ylphenyl)-5-phenyl-N-(4-phenylphenyl)-[1]benzofuro[2,3-g]carbazol-3-amine
CID 161478278
N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-N-[4-[4-[9-(4-ethenylphenyl)carbazol-3-yl]phenyl]phenyl]-4-phenylaniline;N-(4-dibenzothiophen-4-ylphenyl)-N-[4-[4-[9-(4-ethenylphenyl)carbazol-3-yl]phenyl]phenyl]-4-(4-phenylphenyl)aniline
CID 158012362
6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-naphthalen-2-ylcarbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzothiophen-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole
CID 162161949
N-(3-dibenzofuran-4-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylcarbazol-3-yl)aniline
CID 118428329
6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-naphthalen-2-ylcarbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzothiophen-4-yl-9-naphthalen-2-ylcarbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzothiophen-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole
CID 161381988

Frequently Asked Questions

What is the IUPAC name of 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole (CID 159515126) is 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole is c1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)c3c2)cc1.c1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)c3c2)cc1.c1ccc(-c2ccc3c4c5oc6ccccc6c5ccc4n(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)c3c2)cc1.
What is the InChIKey of 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole?
The InChIKey is MBCAJCSWMLUAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O.C42H25NO2.C42H25NOS/c1-3-11-31(12-4-1)34-21-25-40-45(30-34)50(44-28-26-39-38-16-8-10-18-46(38)51-48(39)47(40)44)36-23-19-32(20-24-36)33-22-27-43-41(29-33)37-15-7-9-17-42(37)49(43)35-13-5-2-6-14-35;1-2-9-26(10-3-1)28-19-22-35-37(25-28)43(36-24-23-34-32-12-5-7-16-39(32)45-42(34)40(35)36)29-20-17-27(18-21-29)30-13-8-14-33-31-11-4-6-15-38(31)44-41(30)33;1-2-9-26(10-3-1)28-19-22-35-37(25-28)43(36-24-23-33-31-11-4-6-15-38(31)44-41(33)40(35)36)29-20-17-27(18-21-29)30-13-8-14-34-32-12-5-7-16-39(32)45-42(30)34/h1-30H;2*1-25H.
What are the key properties of 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole?
5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole has a molecular weight of 1818.18 g/mol, XLogP of 37.42, 10 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-dibenzofuran-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-phenyl-[1]benzofuro[3,2-c]carbazole;3-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 159515126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).