9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole

C188H128F6N12 — CID 158576552

IUPAC9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole
SMILESCc1cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(C(F)(F)F)c1.Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(C)c1.Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(C(F)(F)F)c1
InChIInChI=1S/C68H50N4.2C60H39F3N4/c1-43-26-31-54(45(3)36-43)50-28-33-66-59(39-50)60-40-51(55-32-27-44(2)37-46(55)4)29-34-67(60)72(66)65-35-30-52(68-69-61(47-16-7-5-8-17-47)42-62(70-68)48-18-9-6-10-19-48)41-58(65)49-20-15-21-53(38-49)71-63-24-13-11-22-56(63)57-23-12-14-25-64(57)71;1-38-27-30-45(51(33-38)60(61,62)63)42-28-31-58-50(35-42)48-23-10-13-26-56(48)67(58)57-32-29-43(59-64-52(39-15-4-2-5-16-39)37-53(65-59)40-17-6-3-7-18-40)36-49(57)41-19-14-20-44(34-41)66-54-24-11-8-21-46(54)47-22-9-12-25-55(47)66;1-38-31-44(33-45(32-38)60(61,62)63)41-27-29-58-51(35-41)49-23-10-13-26-56(49)67(58)57-30-28-43(59-64-52(39-15-4-2-5-16-39)37-53(65-59)40-17-6-3-7-18-40)36-50(57)42-19-14-20-46(34-42)66-54-24-11-8-21-47(54)48-22-9-12-25-55(48)66/h5-42H,1-4H3;2*2-37H,1H3
InChIKeyHSSPYAZQUUAXFH-UHFFFAOYSA-N
MW2669.16 g/mol
LogP50.57
Rot. Bonds22

About 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole

9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole (PubChem CID 158576552) has the molecular formula C188H128F6N12 and a molecular weight of 2669.16 g/mol. Its IUPAC name is 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole.

Molecular Properties

Compound Name9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole
PubChem CID158576552
Molecular FormulaC188H128F6N12
Molecular Weight2669.16 g/mol
Exact Mass2667.03
IUPAC Name9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole
SMILESCc1cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(C(F)(F)F)c1.Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(C)c1.Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(C(F)(F)F)c1
InChIInChI=1S/C68H50N4.2C60H39F3N4/c1-43-26-31-54(45(3)36-43)50-28-33-66-59(39-50)60-40-51(55-32-27-44(2)37-46(55)4)29-34-67(60)72(66)65-35-30-52(68-69-61(47-16-7-5-8-17-47)42-62(70-68)48-18-9-6-10-19-48)41-58(65)49-20-15-21-53(38-49)71-63-24-13-11-22-56(63)57-23-12-14-25-64(57)71;1-38-27-30-45(51(33-38)60(61,62)63)42-28-31-58-50(35-42)48-23-10-13-26-56(48)67(58)57-32-29-43(59-64-52(39-15-4-2-5-16-39)37-53(65-59)40-17-6-3-7-18-40)36-49(57)41-19-14-20-44(34-41)66-54-24-11-8-21-46(54)47-22-9-12-25-55(47)66;1-38-31-44(33-45(32-38)60(61,62)63)41-27-29-58-51(35-41)49-23-10-13-26-56(49)67(58)57-30-28-43(59-64-52(39-15-4-2-5-16-39)37-53(65-59)40-17-6-3-7-18-40)36-50(57)42-19-14-20-46(34-42)66-54-24-11-8-21-47(54)48-22-9-12-25-55(48)66/h5-42H,1-4H3;2*2-37H,1H3
InChIKeyHSSPYAZQUUAXFH-UHFFFAOYSA-N
XLogP50.57
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds22
Heavy Atoms206
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002669.16
LogP ≤ 550.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole with MolForge

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Related Compounds

9,9',9''-(5-(4,6-Diphenyl-1,3,5-triazin-2-yl)benzene-1,2,3-triyl) tris(3,6-dimethyl-9H-carbazole)
CID 122212559
9-(3-(4-(3,5-Di(9H-carbazol-9-yl)phenyl)-6-phenyl-1,3,5-triazin-2-yl)-5-(9H-carbazol-9-yl)phenyl)-9H-carbazole
CID 102593214
7,18-Bis[2-(trifluoromethyl)phenyl]-6,8,17,19-tetrazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1,3(12),4,6,8,10,13(23),14,16,18,20(24),21,25-tridecaene
CID 139091739
4-(3-Phenylphenanthro[9,10-d]imidazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-2,1,3-benzothiadiazole
CID 168340135
6-(3-Indolo[1,2-c]quinazolin-6-ylnaphthalen-2-yl)indolo[1,2-c]quinazoline
CID 45276790
2,4-Bis{3-(9h-carbazol-9-yl)-9h-carbazol-9-yl}-6-phenyl-1,3,5-triazine
CID 102489904
9-[2,3,4,5-Tetra(carbazol-9-yl)-6-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 121401498
3-[9-(4,6-Diphenylpyrimidin-2-yl)carbazol-2-yl]-9-[3-(2,2,2-trifluoroethyl)phenyl]carbazole
CID 58511268
9-[4-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenyl]-6-fluoro-2-(9-phenylcarbazol-3-yl)carbazole
CID 58511327
3-[9-[4-(2,6-Diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-6-fluoro-9-phenylcarbazole
CID 58511555
3-[9-[3-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 58511581
9-[4-(2,6-Diphenylpyrimidin-4-yl)phenyl]-3-fluoro-6-(9-phenylcarbazol-3-yl)carbazole
CID 58511633

Frequently Asked Questions

What is the IUPAC name of 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole?
The IUPAC name of 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole (CID 158576552) is 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole.
What is the SMILES notation for 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole?
The canonical SMILES for 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole is Cc1cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(C(F)(F)F)c1.Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(C)c1.Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(C(F)(F)F)c1.
What is the InChIKey of 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole?
The InChIKey is HSSPYAZQUUAXFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H50N4.2C60H39F3N4/c1-43-26-31-54(45(3)36-43)50-28-33-66-59(39-50)60-40-51(55-32-27-44(2)37-46(55)4)29-34-67(60)72(66)65-35-30-52(68-69-61(47-16-7-5-8-17-47)42-62(70-68)48-18-9-6-10-19-48)41-58(65)49-20-15-21-53(38-49)71-63-24-13-11-22-56(63)57-23-12-14-25-64(57)71;1-38-27-30-45(51(33-38)60(61,62)63)42-28-31-58-50(35-42)48-23-10-13-26-56(48)67(58)57-32-29-43(59-64-52(39-15-4-2-5-16-39)37-53(65-59)40-17-6-3-7-18-40)36-49(57)41-19-14-20-44(34-41)66-54-24-11-8-21-46(54)47-22-9-12-25-55(47)66;1-38-31-44(33-45(32-38)60(61,62)63)41-27-29-58-51(35-41)49-23-10-13-26-56(49)67(58)57-30-28-43(59-64-52(39-15-4-2-5-16-39)37-53(65-59)40-17-6-3-7-18-40)36-50(57)42-19-14-20-46(34-42)66-54-24-11-8-21-47(54)48-22-9-12-25-55(48)66/h5-42H,1-4H3;2*2-37H,1H3.
What are the key properties of 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole?
9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole has a molecular weight of 2669.16 g/mol, XLogP of 50.57, 22 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3,6-bis(2,4-dimethylphenyl)carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[3-methyl-5-(trifluoromethyl)phenyl]carbazole;9-[2-(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[4-methyl-2-(trifluoromethyl)phenyl]carbazole is sourced from PubChem (CID 158576552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).