3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole

C122H78N10 — CID 158224384

IUPAC3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-n4c5ccccc5c5c(-c6cccc7c6c6ccccc6n7-c6ccc(-c7ccccn7)cc6)cccc54)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-n4c5ccccc5c5c(-c6cccc7c6c6ccccc6n7-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cccc54)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C63H40N6.C59H38N4/c1-5-19-41(20-6-1)44-35-37-55-51(39-44)52-40-46(36-38-56(52)67(55)45-25-11-4-12-26-45)68-53-31-15-13-27-49(53)59-47(29-17-33-57(59)68)48-30-18-34-58-60(48)50-28-14-16-32-54(50)69(58)63-65-61(42-21-7-2-8-22-42)64-62(66-63)43-23-9-3-10-24-43;1-3-15-39(16-4-1)41-30-34-54-49(37-41)50-38-44(33-35-55(50)61(54)42-17-5-2-6-18-42)63-53-25-10-8-20-48(53)59-46(22-14-27-57(59)63)45-21-13-26-56-58(45)47-19-7-9-24-52(47)62(56)43-31-28-40(29-32-43)51-23-11-12-36-60-51/h1-40H;1-38H
InChIKeyGDPWSSJUKGFSDS-UHFFFAOYSA-N
MW1684.04 g/mol
LogP31.20
Rot. Bonds13

About 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole

3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole (PubChem CID 158224384) has the molecular formula C122H78N10 and a molecular weight of 1684.04 g/mol. Its IUPAC name is 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole.

Molecular Properties

Compound Name3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole
PubChem CID158224384
Molecular FormulaC122H78N10
Molecular Weight1684.04 g/mol
Exact Mass1682.64
IUPAC Name3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-n4c5ccccc5c5c(-c6cccc7c6c6ccccc6n7-c6ccc(-c7ccccn7)cc6)cccc54)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-n4c5ccccc5c5c(-c6cccc7c6c6ccccc6n7-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cccc54)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C63H40N6.C59H38N4/c1-5-19-41(20-6-1)44-35-37-55-51(39-44)52-40-46(36-38-56(52)67(55)45-25-11-4-12-26-45)68-53-31-15-13-27-49(53)59-47(29-17-33-57(59)68)48-30-18-34-58-60(48)50-28-14-16-32-54(50)69(58)63-65-61(42-21-7-2-8-22-42)64-62(66-63)43-23-9-3-10-24-43;1-3-15-39(16-4-1)41-30-34-54-49(37-41)50-38-44(33-35-55(50)61(54)42-17-5-2-6-18-42)63-53-25-10-8-20-48(53)59-46(22-14-27-57(59)63)45-21-13-26-56-58(45)47-19-7-9-24-52(47)62(56)43-31-28-40(29-32-43)51-23-11-12-36-60-51/h1-40H;1-38H
InChIKeyGDPWSSJUKGFSDS-UHFFFAOYSA-N
XLogP31.20
TPSA81.14 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds13
Heavy Atoms132
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001684.04
LogP ≤ 531.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole with MolForge

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Related Compounds

9-[4,6-bis[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]carbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenylcarbazole;9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylcarbazole
CID 161068654
3-(9-phenylcarbazol-3-yl)-9-[4-[6-(4-phenylphenyl)-2-(4-pyridin-2-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 176826323
4-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 157250623
4-(9-phenylcarbazol-4-yl)-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 155305706
9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole;4-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-9-phenylcarbazole
CID 157253653
9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-phenylphenyl)-14-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-phenyl-14-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 160744147
3-[4-[9-(4-carbazol-9-ylphenyl)carbazol-4-yl]carbazol-9-yl]-9-phenylcarbazole;3,9-diphenyl-6-[4-(9-phenylcarbazol-4-yl)carbazol-9-yl]carbazole
CID 159143760
8-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-5-phenylpyrido[3,2-b]indole;8-[9-(2,6-dipyridin-2-yl-4-pyridinyl)carbazol-4-yl]-5-phenylpyrido[3,2-b]indole
CID 161498366
4-(9-phenylcarbazol-3-yl)-9-[4-phenyl-6-[4-(9-phenylcarbazol-3-yl)carbazol-9-yl]-1,3,5-triazin-2-yl]carbazole
CID 137470533
6-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 159460585
3-[9-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazol-3-yl]-9-[4-[3-[4-[4-[3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazole
CID 155257157
14-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,9-diphenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 155153308

Frequently Asked Questions

What is the IUPAC name of 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole?
The IUPAC name of 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole (CID 158224384) is 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole.
What is the SMILES notation for 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole?
The canonical SMILES for 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole is c1ccc(-c2ccc3c(c2)c2cc(-n4c5ccccc5c5c(-c6cccc7c6c6ccccc6n7-c6ccc(-c7ccccn7)cc6)cccc54)ccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-n4c5ccccc5c5c(-c6cccc7c6c6ccccc6n7-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cccc54)ccc2n3-c2ccccc2)cc1.
What is the InChIKey of 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole?
The InChIKey is GDPWSSJUKGFSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H40N6.C59H38N4/c1-5-19-41(20-6-1)44-35-37-55-51(39-44)52-40-46(36-38-56(52)67(55)45-25-11-4-12-26-45)68-53-31-15-13-27-49(53)59-47(29-17-33-57(59)68)48-30-18-34-58-60(48)50-28-14-16-32-54(50)69(58)63-65-61(42-21-7-2-8-22-42)64-62(66-63)43-23-9-3-10-24-43;1-3-15-39(16-4-1)41-30-34-54-49(37-41)50-38-44(33-35-55(50)61(54)42-17-5-2-6-18-42)63-53-25-10-8-20-48(53)59-46(22-14-27-57(59)63)45-21-13-26-56-58(45)47-19-7-9-24-52(47)62(56)43-31-28-40(29-32-43)51-23-11-12-36-60-51/h1-40H;1-38H.
What are the key properties of 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole?
3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole has a molecular weight of 1684.04 g/mol, XLogP of 31.20, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3,9-diphenyl-6-[4-[9-(4-pyridin-2-ylphenyl)carbazol-4-yl]carbazol-9-yl]carbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazol-9-yl]-6,9-diphenylcarbazole is sourced from PubChem (CID 158224384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).