1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline

C292H179N21O7S — CID 161399029

IUPAC1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline
SMILESc1ccc(-c2cc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)nc(-c3cccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)c3)n2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc5c4sc4ccccc45)c3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2nc3c(-c4ccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)cc4)cccc3c3c2oc2ccccc23)cc1.c1ccc(-c2nc3c(-c4cccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)c4)cccc3c3c2oc2ccccc23)cc1
InChIInChI=1S/C55H34N4O.C55H33N3O2.C55H33N3OS.C43H27N3O.2C42H26N4O/c1-3-14-36(15-4-1)46-34-47(37-30-32-40(33-31-37)59-48-23-10-7-18-42(48)43-19-8-11-24-49(43)59)58-55(57-46)39-28-26-35(27-29-39)41-21-13-22-45-51(41)52-44-20-9-12-25-50(44)60-54(52)53(56-45)38-16-5-2-6-17-38;1-3-14-35(15-4-1)46-33-47(36-30-28-34(29-31-36)41-23-12-24-43-42-20-7-9-26-48(42)59-53(41)43)58-55(57-46)39-19-11-18-38(32-39)40-22-13-25-45-50(40)51-44-21-8-10-27-49(44)60-54(51)52(56-45)37-16-5-2-6-17-37;1-3-14-35(15-4-1)46-33-47(39-19-11-18-38(32-39)41-23-12-24-43-42-20-8-10-27-49(42)60-54(41)43)58-55(57-46)37-30-28-34(29-31-37)40-22-13-25-45-50(40)51-44-21-7-9-26-48(44)59-53(51)52(56-45)36-16-5-2-6-17-36;1-4-13-29(14-5-1)36-27-37(30-15-6-2-7-16-30)46-43(45-36)32-25-23-28(24-26-32)33-20-12-21-35-39(33)40-34-19-10-11-22-38(34)47-42(40)41(44-35)31-17-8-3-9-18-31;1-2-12-27(13-3-1)40-42-39(32-16-4-5-21-38(32)47-42)33-18-11-17-31(41(33)46-40)29-15-10-14-28(24-29)30-25-36(34-19-6-8-22-43-34)45-37(26-30)35-20-7-9-23-44-35;1-2-11-29(12-3-1)40-42-39(32-13-4-5-18-38(32)47-42)33-15-10-14-31(41(33)46-40)28-21-19-27(20-22-28)30-25-36(34-16-6-8-23-43-34)45-37(26-30)35-17-7-9-24-44-35/h1-34H;2*1-33H;1-27H;2*1-26H
InChIKeyVTZJULWGTLHYKB-UHFFFAOYSA-N
MW4125.85 g/mol
LogP77.04
Rot. Bonds33

About 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline

1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline (PubChem CID 161399029) has the molecular formula C292H179N21O7S and a molecular weight of 4125.85 g/mol. Its IUPAC name is 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline.

Molecular Properties

Compound Name1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline
PubChem CID161399029
Molecular FormulaC292H179N21O7S
Molecular Weight4125.85 g/mol
Exact Mass4122.40
IUPAC Name1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline
SMILESc1ccc(-c2cc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)nc(-c3cccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)c3)n2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc5c4sc4ccccc45)c3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2nc3c(-c4ccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)cc4)cccc3c3c2oc2ccccc23)cc1.c1ccc(-c2nc3c(-c4cccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)c4)cccc3c3c2oc2ccccc23)cc1
InChIInChI=1S/C55H34N4O.C55H33N3O2.C55H33N3OS.C43H27N3O.2C42H26N4O/c1-3-14-36(15-4-1)46-34-47(37-30-32-40(33-31-37)59-48-23-10-7-18-42(48)43-19-8-11-24-49(43)59)58-55(57-46)39-28-26-35(27-29-39)41-21-13-22-45-51(41)52-44-20-9-12-25-50(44)60-54(52)53(56-45)38-16-5-2-6-17-38;1-3-14-35(15-4-1)46-33-47(36-30-28-34(29-31-36)41-23-12-24-43-42-20-7-9-26-48(42)59-53(41)43)58-55(57-46)39-19-11-18-38(32-39)40-22-13-25-45-50(40)51-44-21-8-10-27-49(44)60-54(51)52(56-45)37-16-5-2-6-17-37;1-3-14-35(15-4-1)46-33-47(39-19-11-18-38(32-39)41-23-12-24-43-42-20-8-10-27-49(42)60-54(41)43)58-55(57-46)37-30-28-34(29-31-37)40-22-13-25-45-50(40)51-44-21-7-9-26-48(44)59-53(51)52(56-45)36-16-5-2-6-17-36;1-4-13-29(14-5-1)36-27-37(30-15-6-2-7-16-30)46-43(45-36)32-25-23-28(24-26-32)33-20-12-21-35-39(33)40-34-19-10-11-22-38(34)47-42(40)41(44-35)31-17-8-3-9-18-31;1-2-12-27(13-3-1)40-42-39(32-16-4-5-21-38(32)47-42)33-18-11-17-31(41(33)46-40)29-15-10-14-28(24-29)30-25-36(34-19-6-8-22-43-34)45-37(26-30)35-20-7-9-23-44-35;1-2-11-29(12-3-1)40-42-39(32-13-4-5-18-38(32)47-42)33-15-10-14-31(41(33)46-40)28-21-19-27(20-22-28)30-25-36(34-16-6-8-23-43-34)45-37(26-30)35-17-7-9-24-44-35/h1-34H;2*1-33H;1-27H;2*1-26H
InChIKeyVTZJULWGTLHYKB-UHFFFAOYSA-N
XLogP77.04
TPSA354.71 Ų
H-Bond Donors
H-Bond Acceptors29
Rotatable Bonds33
Heavy Atoms321
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004125.85
LogP ≤ 577.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1029

Analyze 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;2-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;2-[3-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-ylpyrimidin-4-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;6-phenyl-2-[3-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]-[1]benzofuro[2,3-c]quinoline
CID 157061310
1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzothiolo[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzothiolo[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzothiolo[2,3-c]quinoline
CID 160808607
6-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-1-phenyl-[1]benzofuro[2,3-c]quinoline
CID 158269231
4-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline
CID 148953478
6-[4-[6-(4-carbazol-9-ylphenyl)-4-phenyl-2-pyridinyl]phenyl]-[1]benzofuro[3,2-c]quinoline;6-[4-[6-(4-dibenzothiophen-4-ylphenyl)-4-phenyl-2-pyridinyl]phenyl]-[1]benzofuro[3,2-c]quinoline;5-[3-[6-(4-phenanthren-2-ylnaphthalen-1-yl)-2-phenylpyrimidin-4-yl]phenyl]-[1]benzofuro[3,2-c]isoquinoline
CID 163998824
3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyl-[1]benzofuro[3,2-c]quinoline;3-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyl-[1]benzofuro[3,2-c]quinoline;3-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyl-[1]benzofuro[3,2-c]quinoline;3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyl-[1]benzofuro[3,2-c]quinoline;3-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyl-[1]benzofuro[3,2-c]quinoline;3-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyl-[1]benzofuro[3,2-c]quinoline
CID 158087243
4-(3-dibenzothiophen-4-ylphenyl)-6-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-[1]benzofuro[2,3-c]quinoline
CID 159299055
3-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)-1-phenylbenzo[f]quinoline;1-[3-dibenzofuran-2-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylbenzo[f]quinoline;1-[3-dibenzofuran-4-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylbenzo[f]quinoline;1-[3-dibenzothiophen-4-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylbenzo[f]quinoline
CID 162146893
10-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;10-[6-(4-carbazol-9-ylphenyl)-2-phenylpyrimidin-4-yl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;10-(6-dibenzothiophen-4-yl-2-phenylpyrimidin-4-yl)-6-naphthalen-2-yl-[1]benzofuro[2,3-c]quinoline
CID 163595939
1-[4-[2-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-4-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline
CID 162455078
6-[4-[6-(3-dibenzofuran-4-ylphenyl)-2-phenylpyrimidin-4-yl]phenyl]-4-phenyl-[1]benzofuro[2,3-c]quinoline
CID 157187607
1-[3-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline
CID 149128758

Frequently Asked Questions

What is the IUPAC name of 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline?
The IUPAC name of 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline (CID 161399029) is 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline.
What is the SMILES notation for 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline?
The canonical SMILES for 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline is c1ccc(-c2cc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)nc(-c3cccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)c3)n2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cccc5c4sc4ccccc45)c3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4cccc5nc(-c6ccccc6)c6oc7ccccc7c6c45)cc3)n2)cc1.c1ccc(-c2nc3c(-c4ccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)cc4)cccc3c3c2oc2ccccc23)cc1.c1ccc(-c2nc3c(-c4cccc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)c4)cccc3c3c2oc2ccccc23)cc1.
What is the InChIKey of 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline?
The InChIKey is VTZJULWGTLHYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H34N4O.C55H33N3O2.C55H33N3OS.C43H27N3O.2C42H26N4O/c1-3-14-36(15-4-1)46-34-47(37-30-32-40(33-31-37)59-48-23-10-7-18-42(48)43-19-8-11-24-49(43)59)58-55(57-46)39-28-26-35(27-29-39)41-21-13-22-45-51(41)52-44-20-9-12-25-50(44)60-54(52)53(56-45)38-16-5-2-6-17-38;1-3-14-35(15-4-1)46-33-47(36-30-28-34(29-31-36)41-23-12-24-43-42-20-7-9-26-48(42)59-53(41)43)58-55(57-46)39-19-11-18-38(32-39)40-22-13-25-45-50(40)51-44-21-8-10-27-49(44)60-54(51)52(56-45)37-16-5-2-6-17-37;1-3-14-35(15-4-1)46-33-47(39-19-11-18-38(32-39)41-23-12-24-43-42-20-8-10-27-49(42)60-54(41)43)58-55(57-46)37-30-28-34(29-31-37)40-22-13-25-45-50(40)51-44-21-7-9-26-48(44)59-53(51)52(56-45)36-16-5-2-6-17-36;1-4-13-29(14-5-1)36-27-37(30-15-6-2-7-16-30)46-43(45-36)32-25-23-28(24-26-32)33-20-12-21-35-39(33)40-34-19-10-11-22-38(34)47-42(40)41(44-35)31-17-8-3-9-18-31;1-2-12-27(13-3-1)40-42-39(32-16-4-5-21-38(32)47-42)33-18-11-17-31(41(33)46-40)29-15-10-14-28(24-29)30-25-36(34-19-6-8-22-43-34)45-37(26-30)35-20-7-9-23-44-35;1-2-11-29(12-3-1)40-42-39(32-13-4-5-18-38(32)47-42)33-15-10-14-31(41(33)46-40)28-21-19-27(20-22-28)30-25-36(34-16-6-8-23-43-34)45-37(26-30)35-17-7-9-24-44-35/h1-34H;2*1-33H;1-27H;2*1-26H.
What are the key properties of 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline?
1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline has a molecular weight of 4125.85 g/mol, XLogP of 77.04, 33 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[4-(4-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[3-[4-(4-dibenzofuran-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-phenyl-[1]benzofuro[2,3-c]quinoline is sourced from PubChem (CID 161399029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).