9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine

C200H134N22 — CID 158020152

IUPAC9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine
SMILESc1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3nc(-c4ccccc4)cc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)n3)n2)cc1.c1ccc(-c2cc(-c3cccc(N(c4ccccc4)c4ccccc4)c3)nc(-c3nc(-c4ccccc4)cc(-c4cccc(N(c5ccccc5)c5ccccc5)c4)n3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3nc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)n3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)n2)cc1
InChIInChI=1S/2C56H36N6.C56H40N6.C32H22N4/c1-3-17-37(18-4-1)47-35-49(39-21-15-23-41(33-39)61-51-29-11-7-25-43(51)44-26-8-12-30-52(44)61)59-55(57-47)56-58-48(38-19-5-2-6-20-38)36-50(60-56)40-22-16-24-42(34-40)62-53-31-13-9-27-45(53)46-28-10-14-32-54(46)62;1-3-17-37(18-4-1)47-35-48(38-19-5-2-6-20-38)58-55(57-47)56-59-49(39-21-15-23-41(33-39)61-51-29-11-7-25-43(51)44-26-8-12-30-52(44)61)36-50(60-56)40-22-16-24-42(34-40)62-53-31-13-9-27-45(53)46-28-10-14-32-54(46)62;1-7-21-41(22-8-1)51-39-53(43-25-19-35-49(37-43)61(45-27-11-3-12-28-45)46-29-13-4-14-30-46)59-55(57-51)56-58-52(42-23-9-2-10-24-42)40-54(60-56)44-26-20-36-50(38-44)62(47-31-15-5-16-32-47)48-33-17-6-18-34-48;1-5-13-23(14-6-1)27-21-28(24-15-7-2-8-16-24)34-31(33-27)32-35-29(25-17-9-3-10-18-25)22-30(36-32)26-19-11-4-12-20-26/h2*1-36H;1-40H;1-22H
InChIKeyFFYPYJMAYSOPOP-UHFFFAOYSA-N
MW2845.43 g/mol
LogP49.73
Rot. Bonds30

About 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine

9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine (PubChem CID 158020152) has the molecular formula C200H134N22 and a molecular weight of 2845.43 g/mol. Its IUPAC name is 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine.

Molecular Properties

Compound Name9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine
PubChem CID158020152
Molecular FormulaC200H134N22
Molecular Weight2845.43 g/mol
Exact Mass2843.12
IUPAC Name9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine
SMILESc1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3nc(-c4ccccc4)cc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)n3)n2)cc1.c1ccc(-c2cc(-c3cccc(N(c4ccccc4)c4ccccc4)c3)nc(-c3nc(-c4ccccc4)cc(-c4cccc(N(c5ccccc5)c5ccccc5)c4)n3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3nc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)n3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)n2)cc1
InChIInChI=1S/2C56H36N6.C56H40N6.C32H22N4/c1-3-17-37(18-4-1)47-35-49(39-21-15-23-41(33-39)61-51-29-11-7-25-43(51)44-26-8-12-30-52(44)61)59-55(57-47)56-58-48(38-19-5-2-6-20-38)36-50(60-56)40-22-16-24-42(34-40)62-53-31-13-9-27-45(53)46-28-10-14-32-54(46)62;1-3-17-37(18-4-1)47-35-48(38-19-5-2-6-20-38)58-55(57-47)56-59-49(39-21-15-23-41(33-39)61-51-29-11-7-25-43(51)44-26-8-12-30-52(44)61)36-50(60-56)40-22-16-24-42(34-40)62-53-31-13-9-27-45(53)46-28-10-14-32-54(46)62;1-7-21-41(22-8-1)51-39-53(43-25-19-35-49(37-43)61(45-27-11-3-12-28-45)46-29-13-4-14-30-46)59-55(57-51)56-58-52(42-23-9-2-10-24-42)40-54(60-56)44-26-20-36-50(38-44)62(47-31-15-5-16-32-47)48-33-17-6-18-34-48;1-5-13-23(14-6-1)27-21-28(24-15-7-2-8-16-24)34-31(33-27)32-35-29(25-17-9-3-10-18-25)22-30(36-32)26-19-11-4-12-20-26/h2*1-36H;1-40H;1-22H
InChIKeyFFYPYJMAYSOPOP-UHFFFAOYSA-N
XLogP49.73
TPSA232.44 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds30
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002845.43
LogP ≤ 549.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine with MolForge

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Related Compounds

N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline
CID 121312804
3-(3-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline;4-(4-carbazol-9-ylphenyl)-N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-3-phenyl-N-(3-phenylphenyl)aniline
CID 161304112
3-(3-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline;3-(4-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline;3-(3-carbazol-9-ylphenyl)-N-phenyl-N-(4-phenylphenyl)aniline;N-[4-(3-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 158440650
N,N-diphenyl-9-[3-[2-[3-(N-phenylanilino)carbazol-9-yl]-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]carbazol-3-amine
CID 134236708
N-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-N-phenyl-3-(9-phenylcarbazol-3-yl)aniline;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-2-yl]-9-phenylcarbazole;3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 157474914
9-[4-[2,6-bis[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 126630575
N-[3-[2,6-bis[3-[4-(9-phenylcarbazol-1-yl)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]pyrimidin-4-yl]phenyl]-9-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]carbazol-3-amine
CID 126631752
3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-N,N-bis(4-phenylphenyl)aniline
CID 118506889
9-[3-[2-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-6-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 126632710
9-[3-[6-(3,5-diphenylphenyl)-2-phenylpyrimidin-4-yl]phenyl]carbazole
CID 164822819
1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]-3-N-[3-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 177275807
9-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-3-[9-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]carbazole;9-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-3-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]carbazole
CID 159465989

Frequently Asked Questions

What is the IUPAC name of 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine?
The IUPAC name of 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine (CID 158020152) is 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine.
What is the SMILES notation for 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine?
The canonical SMILES for 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine is c1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3nc(-c4ccccc4)cc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)n3)n2)cc1.c1ccc(-c2cc(-c3cccc(N(c4ccccc4)c4ccccc4)c3)nc(-c3nc(-c4ccccc4)cc(-c4cccc(N(c5ccccc5)c5ccccc5)c4)n3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3nc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)n3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)n2)cc1.
What is the InChIKey of 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine?
The InChIKey is FFYPYJMAYSOPOP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H36N6.C56H40N6.C32H22N4/c1-3-17-37(18-4-1)47-35-49(39-21-15-23-41(33-39)61-51-29-11-7-25-43(51)44-26-8-12-30-52(44)61)59-55(57-47)56-58-48(38-19-5-2-6-20-38)36-50(60-56)40-22-16-24-42(34-40)62-53-31-13-9-27-45(53)46-28-10-14-32-54(46)62;1-3-17-37(18-4-1)47-35-48(38-19-5-2-6-20-38)58-55(57-47)56-59-49(39-21-15-23-41(33-39)61-51-29-11-7-25-43(51)44-26-8-12-30-52(44)61)36-50(60-56)40-22-16-24-42(34-40)62-53-31-13-9-27-45(53)46-28-10-14-32-54(46)62;1-7-21-41(22-8-1)51-39-53(43-25-19-35-49(37-43)61(45-27-11-3-12-28-45)46-29-13-4-14-30-46)59-55(57-51)56-58-52(42-23-9-2-10-24-42)40-54(60-56)44-26-20-36-50(38-44)62(47-31-15-5-16-32-47)48-33-17-6-18-34-48;1-5-13-23(14-6-1)27-21-28(24-15-7-2-8-16-24)34-31(33-27)32-35-29(25-17-9-3-10-18-25)22-30(36-32)26-19-11-4-12-20-26/h2*1-36H;1-40H;1-22H.
What are the key properties of 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine?
9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine has a molecular weight of 2845.43 g/mol, XLogP of 49.73, 30 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[6-(3-carbazol-9-ylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)pyrimidin-4-yl]phenyl]carbazole;9-[3-[2-[4-(3-carbazol-9-ylphenyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]phenyl]carbazole;N,N-diphenyl-3-[6-phenyl-2-[4-phenyl-6-[3-(N-phenylanilino)phenyl]pyrimidin-2-yl]pyrimidin-4-yl]aniline;2-(4,6-diphenylpyrimidin-2-yl)-4,6-diphenylpyrimidine is sourced from PubChem (CID 158020152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).