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

C216H195N15 — CID 159211849

IUPAC9-[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
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2cc(-c3cc(C)nc(C)n3)cc(-c3ccc(-n4c5ccc(C)cc5c5cc(C)ccc54)cc3)c2-n2c3c(C)c(C)c(C)c(C)c3c3c(C)c(C)c(C)c(C)c32)cc1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(-c2cc(-c3cc(C)nc(C)n3)cc(-c3cccc(-n4c5ccc(C)cc5c5cc(C)ccc54)c3)c2-n2c3c(C)c(C)c(C)c(C)c3c3c(C)c(C)c(C)c(C)c32)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccccc1-c1cc(-c2cc(C)nc(C)n2)cc(-c2ccccc2-n2c3ccc(C)cc3c3cc(C)ccc32)c1-n1c2c(C)c(C)c(C)c(C)c2c2c(C)c(C)c(C)c(C)c21
InChIInChI=1S/3C72H65N5/c1-38-15-27-64-59(31-38)60-32-39(2)16-28-65(60)75(64)55-23-19-52(20-24-55)57-36-54(63-35-42(5)73-51(14)74-63)37-58(53-21-25-56(26-22-53)76-66-29-17-40(3)33-61(66)62-34-41(4)18-30-67(62)76)72(57)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77;1-38-21-25-64-59(29-38)60-30-39(2)22-26-65(60)75(64)55-19-15-17-52(34-55)57-36-54(63-33-42(5)73-51(14)74-63)37-58(53-18-16-20-56(35-53)76-66-27-23-40(3)31-61(66)62-32-41(4)24-28-67(62)76)72(57)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77;1-38-23-27-64-55(31-38)56-32-39(2)24-28-65(56)75(64)62-21-17-15-19-53(62)59-36-52(61-35-42(5)73-51(14)74-61)37-60(54-20-16-18-22-63(54)76-66-29-25-40(3)33-57(66)58-34-41(4)26-30-67(58)76)72(59)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77/h3*15-37H,1-14H3
InChIKeyKQOXNVNMLDENPC-UHFFFAOYSA-N
MW3001.04 g/mol
LogP57.26
Rot. Bonds18

About 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

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 (PubChem CID 159211849) has the molecular formula C216H195N15 and a molecular weight of 3001.04 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name9-[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
PubChem CID159211849
Molecular FormulaC216H195N15
Molecular Weight3001.04 g/mol
Exact Mass2998.57
IUPAC Name9-[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
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2cc(-c3cc(C)nc(C)n3)cc(-c3ccc(-n4c5ccc(C)cc5c5cc(C)ccc54)cc3)c2-n2c3c(C)c(C)c(C)c(C)c3c3c(C)c(C)c(C)c(C)c32)cc1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(-c2cc(-c3cc(C)nc(C)n3)cc(-c3cccc(-n4c5ccc(C)cc5c5cc(C)ccc54)c3)c2-n2c3c(C)c(C)c(C)c(C)c3c3c(C)c(C)c(C)c(C)c32)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccccc1-c1cc(-c2cc(C)nc(C)n2)cc(-c2ccccc2-n2c3ccc(C)cc3c3cc(C)ccc32)c1-n1c2c(C)c(C)c(C)c(C)c2c2c(C)c(C)c(C)c(C)c21
InChIInChI=1S/3C72H65N5/c1-38-15-27-64-59(31-38)60-32-39(2)16-28-65(60)75(64)55-23-19-52(20-24-55)57-36-54(63-35-42(5)73-51(14)74-63)37-58(53-21-25-56(26-22-53)76-66-29-17-40(3)33-61(66)62-34-41(4)18-30-67(62)76)72(57)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77;1-38-21-25-64-59(29-38)60-30-39(2)22-26-65(60)75(64)55-19-15-17-52(34-55)57-36-54(63-33-42(5)73-51(14)74-63)37-58(53-18-16-20-56(35-53)76-66-27-23-40(3)31-61(66)62-32-41(4)24-28-67(62)76)72(57)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77;1-38-23-27-64-55(31-38)56-32-39(2)24-28-65(56)75(64)62-21-17-15-19-53(62)59-36-52(61-35-42(5)73-51(14)74-61)37-60(54-20-16-18-22-63(54)76-66-29-25-40(3)33-57(66)58-34-41(4)26-30-67(58)76)72(59)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77/h3*15-37H,1-14H3
InChIKeyKQOXNVNMLDENPC-UHFFFAOYSA-N
XLogP57.26
TPSA121.71 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms231
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003001.04
LogP ≤ 557.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 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 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

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
9-[2-(2,6-dimethylpyrimidin-4-yl)-4-[2-(3-methylcarbazol-9-yl)phenyl]phenyl]-3-methylcarbazole
CID 158390729
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
9-[2,6-bis(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-methylcarbazole
CID 158632518
9-[2-[3-[2-(3,6-dimethylcarbazol-9-yl)-4-(4,6-dimethyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-(4,6-dimethyl-1,3,5-triazin-2-yl)phenyl]-3,6-dimethylcarbazole
CID 163501090
9-[2-[3-[3-(3,6-dimethylcarbazol-9-yl)-4-(4,6-dimethyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-(4,6-dimethyl-1,3,5-triazin-2-yl)phenyl]-3,6-dimethylcarbazole;9-[2-[3-[4-(3,6-dimethylcarbazol-9-yl)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-(4,6-dimethyl-1,3,5-triazin-2-yl)phenyl]-3,6-dimethylcarbazole
CID 163902535
6-methyl-1-phenyl-9-(9-phenylcarbazol-3-yl)carbazole
CID 170365229
9-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]-2-(2,5,6-trimethylpyrimidin-4-yl)phenyl]-3,6-dimethylcarbazole
CID 157495787
3-(3-carbazol-9-ylphenyl)-9-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 170060135
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

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2cc(-c3cc(C)nc(C)n3)cc(-c3ccc(-n4c5ccc(C)cc5c5cc(C)ccc54)cc3)c2-n2c3c(C)c(C)c(C)c(C)c3c3c(C)c(C)c(C)c(C)c32)cc1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(-c2cc(-c3cc(C)nc(C)n3)cc(-c3cccc(-n4c5ccc(C)cc5c5cc(C)ccc54)c3)c2-n2c3c(C)c(C)c(C)c(C)c3c3c(C)c(C)c(C)c(C)c32)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccccc1-c1cc(-c2cc(C)nc(C)n2)cc(-c2ccccc2-n2c3ccc(C)cc3c3cc(C)ccc32)c1-n1c2c(C)c(C)c(C)c(C)c2c2c(C)c(C)c(C)c(C)c21.
What is the InChIKey of 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?
The InChIKey is KQOXNVNMLDENPC-UHFFFAOYSA-N. The full InChI is InChI=1S/3C72H65N5/c1-38-15-27-64-59(31-38)60-32-39(2)16-28-65(60)75(64)55-23-19-52(20-24-55)57-36-54(63-35-42(5)73-51(14)74-63)37-58(53-21-25-56(26-22-53)76-66-29-17-40(3)33-61(66)62-34-41(4)18-30-67(62)76)72(57)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77;1-38-21-25-64-59(29-38)60-30-39(2)22-26-65(60)75(64)55-19-15-17-52(34-55)57-36-54(63-33-42(5)73-51(14)74-63)37-58(53-18-16-20-56(35-53)76-66-27-23-40(3)31-61(66)62-32-41(4)24-28-67(62)76)72(57)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77;1-38-23-27-64-55(31-38)56-32-39(2)24-28-65(56)75(64)62-21-17-15-19-53(62)59-36-52(61-35-42(5)73-51(14)74-61)37-60(54-20-16-18-22-63(54)76-66-29-25-40(3)33-57(66)58-34-41(4)26-30-67(58)76)72(59)77-70-49(12)45(8)43(6)47(10)68(70)69-48(11)44(7)46(9)50(13)71(69)77/h3*15-37H,1-14H3.
What are the key properties of 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?
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 has a molecular weight of 3001.04 g/mol, XLogP of 57.26, 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-(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 is sourced from PubChem (CID 159211849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).