3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole

C142H93FN10OS — CID 161183545

IUPAC3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole
SMILESCc1cc(C)cc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7sc8ccccc8c7c6)ccc54)cc3)nc3ccccc23)c1.Cc1cc(C)cc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5nc(-c6ccccc6)c6ccccc6n5)cc4)ccc32)c1.Fc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7oc8ccccc8c7c6)ccc54)cc3)nc3ccccc23)cc1
InChIInChI=1S/C52H36N4.C46H31N3S.C44H26FN3O/c1-33-28-34(2)30-40(29-33)56-48-19-11-8-15-42(48)45-32-38(23-27-50(45)56)37-22-26-49-44(31-37)41-14-7-10-18-47(41)55(49)39-24-20-36(21-25-39)52-53-46-17-9-6-16-43(46)51(54-52)35-12-4-3-5-13-35;1-28-23-29(2)25-33(24-28)45-37-11-3-6-12-40(37)47-46(48-45)30-15-19-34(20-16-30)49-41-13-7-4-9-35(41)38-26-31(17-21-42(38)49)32-18-22-44-39(27-32)36-10-5-8-14-43(36)50-44;45-31-19-13-27(14-20-31)43-35-9-1-4-10-38(35)46-44(47-43)28-15-21-32(22-16-28)48-39-11-5-2-7-33(39)36-25-29(17-23-40(36)48)30-18-24-42-37(26-30)34-8-3-6-12-41(34)49-42/h3-32H,1-2H3;3-27H,1-2H3;1-26H
InChIKeyUSUFPCIEKCVUPG-UHFFFAOYSA-N
MW2006.44 g/mol
LogP37.92
Rot. Bonds13

About 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole

3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole (PubChem CID 161183545) has the molecular formula C142H93FN10OS and a molecular weight of 2006.44 g/mol. Its IUPAC name is 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole
PubChem CID161183545
Molecular FormulaC142H93FN10OS
Molecular Weight2006.44 g/mol
Exact Mass2004.72
IUPAC Name3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole
SMILESCc1cc(C)cc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7sc8ccccc8c7c6)ccc54)cc3)nc3ccccc23)c1.Cc1cc(C)cc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5nc(-c6ccccc6)c6ccccc6n5)cc4)ccc32)c1.Fc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7oc8ccccc8c7c6)ccc54)cc3)nc3ccccc23)cc1
InChIInChI=1S/C52H36N4.C46H31N3S.C44H26FN3O/c1-33-28-34(2)30-40(29-33)56-48-19-11-8-15-42(48)45-32-38(23-27-50(45)56)37-22-26-49-44(31-37)41-14-7-10-18-47(41)55(49)39-24-20-36(21-25-39)52-53-46-17-9-6-16-43(46)51(54-52)35-12-4-3-5-13-35;1-28-23-29(2)25-33(24-28)45-37-11-3-6-12-40(37)47-46(48-45)30-15-19-34(20-16-30)49-41-13-7-4-9-35(41)38-26-31(17-21-42(38)49)32-18-22-44-39(27-32)36-10-5-8-14-43(36)50-44;45-31-19-13-27(14-20-31)43-35-9-1-4-10-38(35)46-44(47-43)28-15-21-32(22-16-28)48-39-11-5-2-7-33(39)36-25-29(17-23-40(36)48)30-18-24-42-37(26-30)34-8-3-6-12-41(34)49-42/h3-32H,1-2H3;3-27H,1-2H3;1-26H
InChIKeyUSUFPCIEKCVUPG-UHFFFAOYSA-N
XLogP37.92
TPSA110.20 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms155
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002006.44
LogP ≤ 537.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole with MolForge

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Related Compounds

3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]carbazole;9-(4-dibenzofuran-4-ylphenyl)-3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[4-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole
CID 159742632
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 158229198
3-dibenzofuran-2-yl-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazole
CID 160542300
3-dibenzofuran-2-yl-9-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]-6-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126632019
3-dibenzofuran-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
CID 160651391
3-dibenzofuran-2-yl-9-(3,5-diphenylphenyl)carbazole;3-dibenzothiophen-2-yl-9-(3,5-diphenylphenyl)carbazole;3-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
CID 160571144
3-carbazol-9-yl-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;3-carbazol-9-yl-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazole;3,6-di(carbazol-9-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 159267968
9-[3-dibenzofuran-2-yl-5-(6-dibenzothiophen-2-yl-2-phenylpyrimidin-4-yl)phenyl]carbazole
CID 147547401
3-dibenzothiophen-2-yl-9-[4-[6-[3-(3-dibenzothiophen-2-ylcarbazol-9-yl)phenyl]-2-[4-(3-dibenzothiophen-2-ylcarbazol-9-yl)phenyl]quinazolin-4-yl]phenyl]carbazole
CID 126632050
3-[2-(3-dibenzothiophen-2-ylphenyl)-4-phenylquinazolin-6-yl]-9-phenylcarbazole
CID 145159010
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(8-phenyldibenzofuran-2-yl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(8-phenyldibenzothiophen-2-yl)carbazole;9-(8-phenyldibenzothiophen-2-yl)-3-[9-(8-phenyldibenzothiophen-2-yl)carbazol-3-yl]carbazole
CID 161271655
9-dibenzofuran-2-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-dibenzothiophen-2-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3,6,9-tris(9-phenylcarbazol-3-yl)carbazole
CID 161382413

Frequently Asked Questions

What is the IUPAC name of 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole?
The IUPAC name of 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole (CID 161183545) is 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole.
What is the SMILES notation for 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole?
The canonical SMILES for 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole is Cc1cc(C)cc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7sc8ccccc8c7c6)ccc54)cc3)nc3ccccc23)c1.Cc1cc(C)cc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5nc(-c6ccccc6)c6ccccc6n5)cc4)ccc32)c1.Fc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7oc8ccccc8c7c6)ccc54)cc3)nc3ccccc23)cc1.
What is the InChIKey of 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole?
The InChIKey is USUFPCIEKCVUPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H36N4.C46H31N3S.C44H26FN3O/c1-33-28-34(2)30-40(29-33)56-48-19-11-8-15-42(48)45-32-38(23-27-50(45)56)37-22-26-49-44(31-37)41-14-7-10-18-47(41)55(49)39-24-20-36(21-25-39)52-53-46-17-9-6-16-43(46)51(54-52)35-12-4-3-5-13-35;1-28-23-29(2)25-33(24-28)45-37-11-3-6-12-40(37)47-46(48-45)30-15-19-34(20-16-30)49-41-13-7-4-9-35(41)38-26-31(17-21-42(38)49)32-18-22-44-39(27-32)36-10-5-8-14-43(36)50-44;45-31-19-13-27(14-20-31)43-35-9-1-4-10-38(35)46-44(47-43)28-15-21-32(22-16-28)48-39-11-5-2-7-33(39)36-25-29(17-23-40(36)48)30-18-24-42-37(26-30)34-8-3-6-12-41(34)49-42/h3-32H,1-2H3;3-27H,1-2H3;1-26H.
What are the key properties of 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole?
3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole has a molecular weight of 2006.44 g/mol, XLogP of 37.92, 13 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dibenzofuran-2-yl-9-[4-[4-(4-fluorophenyl)quinazolin-2-yl]phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-[4-(3,5-dimethylphenyl)quinazolin-2-yl]phenyl]carbazole;3-[9-(3,5-dimethylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole is sourced from PubChem (CID 161183545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).