9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole

C178H134N10 — CID 161414591

IUPAC9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole
SMILESC.C.C.C.c1ccc(-c2cc(-c3ccccc3)cc(C3(c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccccc4-c4ccccc43)c2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7ccccc7)c6cc54)c3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)nc3ccccc23)cc1
InChIInChI=1S/C49H34.C45H29N5.C44H28N4.C36H27N.4CH4/c1-5-17-35(18-6-1)39-29-40(36-19-7-2-8-20-36)32-43(31-39)49(47-27-15-13-25-45(47)46-26-14-16-28-48(46)49)44-33-41(37-21-9-3-10-22-37)30-42(34-44)38-23-11-4-12-24-38;1-4-15-30(16-5-1)43-46-44(31-17-6-2-7-18-31)48-45(47-43)32-19-14-22-34(27-32)50-40-26-13-11-24-36(40)38-28-37-35-23-10-12-25-39(35)49(41(37)29-42(38)50)33-20-8-3-9-21-33;1-3-13-29(14-4-1)43-35-19-7-10-20-38(35)45-44(46-43)48-40-22-12-9-18-34(40)37-28-31(24-26-42(37)48)30-23-25-41-36(27-30)33-17-8-11-21-39(33)47(41)32-15-5-2-6-16-32;1-4-10-28(11-5-1)31-16-22-34(23-17-31)37(35-24-18-32(19-25-35)29-12-6-2-7-13-29)36-26-20-33(21-27-36)30-14-8-3-9-15-30;;;;/h1-34H;1-29H;1-28H;1-27H;4*1H4
InChIKeyVVXJMGAHHJZTJM-UHFFFAOYSA-N
MW2413.10 g/mol
LogP47.64
Rot. Bonds21

About 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole

9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole (PubChem CID 161414591) has the molecular formula C178H134N10 and a molecular weight of 2413.10 g/mol. Its IUPAC name is 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole.

Molecular Properties

Compound Name9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole
PubChem CID161414591
Molecular FormulaC178H134N10
Molecular Weight2413.10 g/mol
Exact Mass2411.08
IUPAC Name9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole
SMILESC.C.C.C.c1ccc(-c2cc(-c3ccccc3)cc(C3(c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccccc4-c4ccccc43)c2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7ccccc7)c6cc54)c3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)nc3ccccc23)cc1
InChIInChI=1S/C49H34.C45H29N5.C44H28N4.C36H27N.4CH4/c1-5-17-35(18-6-1)39-29-40(36-19-7-2-8-20-36)32-43(31-39)49(47-27-15-13-25-45(47)46-26-14-16-28-48(46)49)44-33-41(37-21-9-3-10-22-37)30-42(34-44)38-23-11-4-12-24-38;1-4-15-30(16-5-1)43-46-44(31-17-6-2-7-18-31)48-45(47-43)32-19-14-22-34(27-32)50-40-26-13-11-24-36(40)38-28-37-35-23-10-12-25-39(35)49(41(37)29-42(38)50)33-20-8-3-9-21-33;1-3-13-29(14-4-1)43-35-19-7-10-20-38(35)45-44(46-43)48-40-22-12-9-18-34(40)37-28-31(24-26-42(37)48)30-23-25-41-36(27-30)33-17-8-11-21-39(33)47(41)32-15-5-2-6-16-32;1-4-10-28(11-5-1)31-16-22-34(23-17-31)37(35-24-18-32(19-25-35)29-12-6-2-7-13-29)36-26-20-33(21-27-36)30-14-8-3-9-15-30;;;;/h1-34H;1-29H;1-28H;1-27H;4*1H4
InChIKeyVVXJMGAHHJZTJM-UHFFFAOYSA-N
XLogP47.64
TPSA87.41 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds21
Heavy Atoms188
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002413.10
LogP ≤ 547.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole?
The IUPAC name of 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole (CID 161414591) is 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole.
What is the SMILES notation for 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole?
The canonical SMILES for 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole is C.C.C.C.c1ccc(-c2cc(-c3ccccc3)cc(C3(c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccccc4-c4ccccc43)c2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7ccccc7)c6cc54)c3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)nc3ccccc23)cc1.
What is the InChIKey of 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole?
The InChIKey is VVXJMGAHHJZTJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H34.C45H29N5.C44H28N4.C36H27N.4CH4/c1-5-17-35(18-6-1)39-29-40(36-19-7-2-8-20-36)32-43(31-39)49(47-27-15-13-25-45(47)46-26-14-16-28-48(46)49)44-33-41(37-21-9-3-10-22-37)30-42(34-44)38-23-11-4-12-24-38;1-4-15-30(16-5-1)43-46-44(31-17-6-2-7-18-31)48-45(47-43)32-19-14-22-34(27-32)50-40-26-13-11-24-36(40)38-28-37-35-23-10-12-25-39(35)49(41(37)29-42(38)50)33-20-8-3-9-21-33;1-3-13-29(14-4-1)43-35-19-7-10-20-38(35)45-44(46-43)48-40-22-12-9-18-34(40)37-28-31(24-26-42(37)48)30-23-25-41-36(27-30)33-17-8-11-21-39(33)47(41)32-15-5-2-6-16-32;1-4-10-28(11-5-1)31-16-22-34(23-17-31)37(35-24-18-32(19-25-35)29-12-6-2-7-13-29)36-26-20-33(21-27-36)30-14-8-3-9-15-30;;;;/h1-34H;1-29H;1-28H;1-27H;4*1H4.
What are the key properties of 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole?
9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole has a molecular weight of 2413.10 g/mol, XLogP of 47.64, 21 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(3,5-diphenylphenyl)fluorene;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;methane;4-phenyl-N,N-bis(4-phenylphenyl)aniline;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole is sourced from PubChem (CID 161414591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).