9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole

C100H62N12 — CID 167192804

IUPAC9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc(-c6ccc(-c7nc(-c8cccnc8)nc(-c8cccc(-n9c%10ccccc%10c%10ccccc%109)c8-n8c9ccccc9c9ccccc98)n7)cn6)c5)cc4)nc(-c4cccc(-n5c6ccccc6c6ccccc65)c4-n4c5ccccc5c5ccccc54)n3)cc2)cc1
InChIInChI=1S/C100H62N12/c1-2-24-63(25-3-1)64-49-53-66(54-50-64)95-103-96(106-99(105-95)80-37-21-47-91(109-83-39-12-4-29-72(83)73-30-5-13-40-84(73)109)93(80)111-87-43-16-8-33-76(87)77-34-9-17-44-88(77)111)67-55-51-65(52-56-67)68-26-20-27-69(60-68)82-58-57-71(62-102-82)98-104-97(70-28-23-59-101-61-70)107-100(108-98)81-38-22-48-92(110-85-41-14-6-31-74(85)75-32-7-15-42-86(75)110)94(81)112-89-45-18-10-35-78(89)79-36-11-19-46-90(79)112/h1-62H
InChIKeyKRMJEFRURHNWMU-UHFFFAOYSA-N
MW1431.68 g/mol
LogP24.24
Rot. Bonds13

About 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole

9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole (PubChem CID 167192804) has the molecular formula C100H62N12 and a molecular weight of 1431.68 g/mol. Its IUPAC name is 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole
PubChem CID167192804
Molecular FormulaC100H62N12
Molecular Weight1431.68 g/mol
Exact Mass1430.52
IUPAC Name9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc(-c6ccc(-c7nc(-c8cccnc8)nc(-c8cccc(-n9c%10ccccc%10c%10ccccc%109)c8-n8c9ccccc9c9ccccc98)n7)cn6)c5)cc4)nc(-c4cccc(-n5c6ccccc6c6ccccc65)c4-n4c5ccccc5c5ccccc54)n3)cc2)cc1
InChIInChI=1S/C100H62N12/c1-2-24-63(25-3-1)64-49-53-66(54-50-64)95-103-96(106-99(105-95)80-37-21-47-91(109-83-39-12-4-29-72(83)73-30-5-13-40-84(73)109)93(80)111-87-43-16-8-33-76(87)77-34-9-17-44-88(77)111)67-55-51-65(52-56-67)68-26-20-27-69(60-68)82-58-57-71(62-102-82)98-104-97(70-28-23-59-101-61-70)107-100(108-98)81-38-22-48-92(110-85-41-14-6-31-74(85)75-32-7-15-42-86(75)110)94(81)112-89-45-18-10-35-78(89)79-36-11-19-46-90(79)112/h1-62H
InChIKeyKRMJEFRURHNWMU-UHFFFAOYSA-N
XLogP24.24
TPSA122.84 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms112
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001431.68
LogP ≤ 524.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole with MolForge

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Related Compounds

9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 121401452
2-phenyl-4-(4-phenylphenyl)-6-[3-(5-pyridin-3-yl-2-pyridinyl)phenyl]-1,3,5-triazine
CID 134380944
2-phenyl-4-(4-phenylphenyl)-6-[3-[4-(6-pyridin-3-yl-3-pyridinyl)phenyl]phenyl]-1,3,5-triazine
CID 134380773
9-[4-[6-[2-carbazol-9-yl-5-(3-phenylphenyl)phenyl]-3-pyridinyl]-6-phenyl-1,3,5-triazin-2-yl]-1-phenylcarbazole
CID 139303271
9-[2-[3-[3-[4-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 168801599
2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridin-3-ylphenyl]carbazole
CID 138579049
9-[4-[6-(2-carbazol-9-yl-5-phenylphenyl)-3-pyridinyl]-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenylcarbazole
CID 139303351
9-[2-[3-[4-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]phenyl]phenyl]carbazole
CID 168801567
9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]-2-(4-methylphenyl)carbazole
CID 138578907
9-[2-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]phenyl]carbazole
CID 168801597
2,4-diphenyl-6-[4-[6-[3-(6-phenyl-3-pyridinyl)-5-pyridin-3-ylphenyl]dibenzothiophen-4-yl]phenyl]-1,3,5-triazine
CID 171761000
3,6-di(carbazol-9-yl)-9-[2-[5-[4-[3-[9-[9-[2-[2-(3-carbazol-9-ylcarbazol-9-yl)-6-pyridin-3-ylphenyl]-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]carbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-3-pyridin-3-ylphenyl]carbazole
CID 138663312

Frequently Asked Questions

What is the IUPAC name of 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole?
The IUPAC name of 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole (CID 167192804) is 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole.
What is the SMILES notation for 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole?
The canonical SMILES for 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole is c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc(-c6ccc(-c7nc(-c8cccnc8)nc(-c8cccc(-n9c%10ccccc%10c%10ccccc%109)c8-n8c9ccccc9c9ccccc98)n7)cn6)c5)cc4)nc(-c4cccc(-n5c6ccccc6c6ccccc65)c4-n4c5ccccc5c5ccccc54)n3)cc2)cc1.
What is the InChIKey of 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole?
The InChIKey is KRMJEFRURHNWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C100H62N12/c1-2-24-63(25-3-1)64-49-53-66(54-50-64)95-103-96(106-99(105-95)80-37-21-47-91(109-83-39-12-4-29-72(83)73-30-5-13-40-84(73)109)93(80)111-87-43-16-8-33-76(87)77-34-9-17-44-88(77)111)67-55-51-65(52-56-67)68-26-20-27-69(60-68)82-58-57-71(62-102-82)98-104-97(70-28-23-59-101-61-70)107-100(108-98)81-38-22-48-92(110-85-41-14-6-31-74(85)75-32-7-15-42-86(75)110)94(81)112-89-45-18-10-35-78(89)79-36-11-19-46-90(79)112/h1-62H.
What are the key properties of 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole?
9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole has a molecular weight of 1431.68 g/mol, XLogP of 24.24, 13 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-carbazol-9-yl-6-[4-[6-[3-[4-[4-[2,3-di(carbazol-9-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3-pyridinyl]-6-pyridin-3-yl-1,3,5-triazin-2-yl]phenyl]carbazole is sourced from PubChem (CID 167192804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).