9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole

C204H171N15 — CID 158722373

IUPAC9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole
SMILESCc1cc(-c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c2)nc(C)n1.Cc1cc(-c2cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c2)nc(C)n1.Cc1cc(-c2cc(-c3ccccc3-n3c4ccccc4c4ccccc43)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3ccccc3-n3c4ccccc4c4ccccc43)c2)nc(C)n1
InChIInChI=1S/3C68H57N5/c1-38-35-57(70-47(10)69-38)48-36-55(53-27-15-21-33-62(53)71-58-29-17-11-23-49(58)50-24-12-18-30-59(50)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)56(37-48)54-28-16-22-34-63(54)72-60-31-19-13-25-51(60)52-26-14-20-32-61(52)72;1-38-33-59(70-47(10)69-38)50-36-57(48-21-19-23-51(34-48)71-60-29-15-11-25-53(60)54-26-12-16-30-61(54)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)58(37-50)49-22-20-24-52(35-49)72-62-31-17-13-27-55(62)56-28-14-18-32-63(56)72;1-38-35-59(70-47(10)69-38)50-36-57(48-27-31-51(32-28-48)71-60-23-15-11-19-53(60)54-20-12-16-24-61(54)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)58(37-50)49-29-33-52(34-30-49)72-62-25-17-13-21-55(62)56-22-14-18-26-63(56)72/h3*11-37H,1-10H3
InChIKeyIKBOISQSTAIDQU-UHFFFAOYSA-N
MW2832.72 g/mol
LogP53.56
Rot. Bonds18

About 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole

9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole (PubChem CID 158722373) has the molecular formula C204H171N15 and a molecular weight of 2832.72 g/mol. Its IUPAC name is 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole.

Molecular Properties

Compound Name9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole
PubChem CID158722373
Molecular FormulaC204H171N15
Molecular Weight2832.72 g/mol
Exact Mass2830.38
IUPAC Name9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole
SMILESCc1cc(-c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c2)nc(C)n1.Cc1cc(-c2cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c2)nc(C)n1.Cc1cc(-c2cc(-c3ccccc3-n3c4ccccc4c4ccccc43)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3ccccc3-n3c4ccccc4c4ccccc43)c2)nc(C)n1
InChIInChI=1S/3C68H57N5/c1-38-35-57(70-47(10)69-38)48-36-55(53-27-15-21-33-62(53)71-58-29-17-11-23-49(58)50-24-12-18-30-59(50)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)56(37-48)54-28-16-22-34-63(54)72-60-31-19-13-25-51(60)52-26-14-20-32-61(52)72;1-38-33-59(70-47(10)69-38)50-36-57(48-21-19-23-51(34-48)71-60-29-15-11-25-53(60)54-26-12-16-30-61(54)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)58(37-50)49-22-20-24-52(35-49)72-62-31-17-13-27-55(62)56-28-14-18-32-63(56)72;1-38-35-59(70-47(10)69-38)50-36-57(48-27-31-51(32-28-48)71-60-23-15-11-19-53(60)54-20-12-16-24-61(54)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)58(37-50)49-29-33-52(34-30-49)72-62-25-17-13-21-55(62)56-22-14-18-26-63(56)72/h3*11-37H,1-10H3
InChIKeyIKBOISQSTAIDQU-UHFFFAOYSA-N
XLogP53.56
TPSA121.71 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms219
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002832.72
LogP ≤ 553.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole with MolForge

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Related Compounds

9-[2,6-bis[2-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole
CID 159211849
9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(4,6-dimethylpyrimidin-2-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole
CID 159662334
9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(4,6-dimethylpyrimidin-2-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole
CID 159662335
3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;9-(2-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-(2-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 160944719
9-(2-phenylphenyl)-3-[9-(2-phenylphenyl)carbazol-3-yl]carbazole;9-(2-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-(2-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159485345
3-(3-carbazol-9-ylphenyl)-9-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 170060135
3-(2-carbazol-9-ylphenyl)-9-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 170060036
9-[3-[4-carbazol-9-yl-2-(9H-fluoren-9-yl)phenyl]phenyl]carbazole;9-[2-(2-carbazol-9-ylphenyl)phenyl]carbazole;9-[2-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole
CID 158463997
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[2-(4-phenylphenyl)phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 161451910
9-(2-phenylphenyl)-3-[3-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]carbazole;9-(3-phenylphenyl)-3-[4-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]carbazole
CID 159114299
3-(9-phenylcarbazol-3-yl)-9-[2-[4-(4-phenylphenyl)phenyl]phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-[4-(4-phenylphenyl)phenyl]phenyl]carbazole
CID 161093250
3-(9-phenylcarbazol-3-yl)-9-[2-[2-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2-[3-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-[4-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-[4-[4-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 158217203

Frequently Asked Questions

What is the IUPAC name of 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole?
The IUPAC name of 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole (CID 158722373) is 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole.
What is the SMILES notation for 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole?
The canonical SMILES for 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole is Cc1cc(-c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c2)nc(C)n1.Cc1cc(-c2cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c2)nc(C)n1.Cc1cc(-c2cc(-c3ccccc3-n3c4ccccc4c4ccccc43)c(-n3c4c(C)c(C)c(C)c(C)c4c4c(C)c(C)c(C)c(C)c43)c(-c3ccccc3-n3c4ccccc4c4ccccc43)c2)nc(C)n1.
What is the InChIKey of 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole?
The InChIKey is IKBOISQSTAIDQU-UHFFFAOYSA-N. The full InChI is InChI=1S/3C68H57N5/c1-38-35-57(70-47(10)69-38)48-36-55(53-27-15-21-33-62(53)71-58-29-17-11-23-49(58)50-24-12-18-30-59(50)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)56(37-48)54-28-16-22-34-63(54)72-60-31-19-13-25-51(60)52-26-14-20-32-61(52)72;1-38-33-59(70-47(10)69-38)50-36-57(48-21-19-23-51(34-48)71-60-29-15-11-25-53(60)54-26-12-16-30-61(54)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)58(37-50)49-22-20-24-52(35-49)72-62-31-17-13-27-55(62)56-28-14-18-32-63(56)72;1-38-35-59(70-47(10)69-38)50-36-57(48-27-31-51(32-28-48)71-60-23-15-11-19-53(60)54-20-12-16-24-61(54)71)68(73-66-45(8)41(4)39(2)43(6)64(66)65-44(7)40(3)42(5)46(9)67(65)73)58(37-50)49-29-33-52(34-30-49)72-62-25-17-13-21-55(62)56-22-14-18-26-63(56)72/h3*11-37H,1-10H3.
What are the key properties of 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole?
9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole has a molecular weight of 2832.72 g/mol, XLogP of 53.56, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2,6-bis(2-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole;9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(2,6-dimethylpyrimidin-4-yl)phenyl]-1,2,3,4,5,6,7,8-octamethylcarbazole is sourced from PubChem (CID 158722373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).