11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole

C215H137N13 — CID 159275309

IUPAC11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole
SMILESc1ccc(-c2nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4ccc5c(c43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)cc(-n3c4ccccc4c4ccc5c(c43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)n2)cc1
InChIInChI=1S/2C72H46N4.C71H45N5/c1-6-24-47(25-7-1)70-73-68(75-64-40-22-18-36-54(64)58-42-62-56(44-66(58)75)52-34-16-20-38-60(52)71(62,48-26-8-2-9-27-48)49-28-10-3-11-29-49)46-69(74-70)76-65-41-23-19-37-55(65)59-43-63-57(45-67(59)76)53-35-17-21-39-61(53)72(63,50-30-12-4-13-31-50)51-32-14-5-15-33-51;1-6-24-47(25-7-1)70-73-64(75-62-40-22-18-36-54(62)58-44-42-56-52-34-16-20-38-60(52)71(66(56)68(58)75,48-26-8-2-9-27-48)49-28-10-3-11-29-49)46-65(74-70)76-63-41-23-19-37-55(63)59-45-43-57-53-35-17-21-39-61(53)72(67(57)69(59)76,50-30-12-4-13-31-50)51-32-14-5-15-33-51;1-6-24-46(25-7-1)67-72-68(75-63-40-22-18-36-53(63)57-42-61-55(44-65(57)75)51-34-16-20-38-59(51)70(61,47-26-8-2-9-27-47)48-28-10-3-11-29-48)74-69(73-67)76-64-41-23-19-37-54(64)58-43-62-56(45-66(58)76)52-35-17-21-39-60(52)71(62,49-30-12-4-13-31-49)50-32-14-5-15-33-50/h2*1-46H;1-45H
InChIKeyKYFRMJMGWATIPO-UHFFFAOYSA-N
MW2902.55 g/mol
LogP50.59
Rot. Bonds21

About 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole

11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole (PubChem CID 159275309) has the molecular formula C215H137N13 and a molecular weight of 2902.55 g/mol. Its IUPAC name is 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole.

Molecular Properties

Compound Name11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole
PubChem CID159275309
Molecular FormulaC215H137N13
Molecular Weight2902.55 g/mol
Exact Mass2900.11
IUPAC Name11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole
SMILESc1ccc(-c2nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4ccc5c(c43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)cc(-n3c4ccccc4c4ccc5c(c43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)n2)cc1
InChIInChI=1S/2C72H46N4.C71H45N5/c1-6-24-47(25-7-1)70-73-68(75-64-40-22-18-36-54(64)58-42-62-56(44-66(58)75)52-34-16-20-38-60(52)71(62,48-26-8-2-9-27-48)49-28-10-3-11-29-49)46-69(74-70)76-65-41-23-19-37-55(65)59-43-63-57(45-67(59)76)53-35-17-21-39-61(53)72(63,50-30-12-4-13-31-50)51-32-14-5-15-33-51;1-6-24-47(25-7-1)70-73-64(75-62-40-22-18-36-54(62)58-44-42-56-52-34-16-20-38-60(52)71(66(56)68(58)75,48-26-8-2-9-27-48)49-28-10-3-11-29-49)46-65(74-70)76-63-41-23-19-37-55(63)59-45-43-57-53-35-17-21-39-61(53)72(67(57)69(59)76,50-30-12-4-13-31-50)51-32-14-5-15-33-51;1-6-24-46(25-7-1)67-72-68(75-63-40-22-18-36-53(63)57-42-61-55(44-65(57)75)51-34-16-20-38-59(51)70(61,47-26-8-2-9-27-47)48-28-10-3-11-29-48)74-69(73-67)76-64-41-23-19-37-54(64)58-43-62-56(45-66(58)76)52-35-17-21-39-60(52)71(62,49-30-12-4-13-31-49)50-32-14-5-15-33-50/h2*1-46H;1-45H
InChIKeyKYFRMJMGWATIPO-UHFFFAOYSA-N
XLogP50.59
TPSA119.81 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds21
Heavy Atoms228
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002902.55
LogP ≤ 550.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole?
The IUPAC name of 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole (CID 159275309) is 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole.
What is the SMILES notation for 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole?
The canonical SMILES for 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole is c1ccc(-c2nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)-c3ccccc3C5(c3ccccc3)c3ccccc3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4ccc5c(c43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)cc(-n3c4ccccc4c4ccc5c(c43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)n2)cc1.
What is the InChIKey of 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole?
The InChIKey is KYFRMJMGWATIPO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C72H46N4.C71H45N5/c1-6-24-47(25-7-1)70-73-68(75-64-40-22-18-36-54(64)58-42-62-56(44-66(58)75)52-34-16-20-38-60(52)71(62,48-26-8-2-9-27-48)49-28-10-3-11-29-49)46-69(74-70)76-65-41-23-19-37-55(65)59-43-63-57(45-67(59)76)53-35-17-21-39-61(53)72(63,50-30-12-4-13-31-50)51-32-14-5-15-33-51;1-6-24-47(25-7-1)70-73-64(75-62-40-22-18-36-54(62)58-44-42-56-52-34-16-20-38-60(52)71(66(56)68(58)75,48-26-8-2-9-27-48)49-28-10-3-11-29-49)46-65(74-70)76-63-41-23-19-37-55(63)59-45-43-57-53-35-17-21-39-61(53)72(67(57)69(59)76,50-30-12-4-13-31-50)51-32-14-5-15-33-51;1-6-24-46(25-7-1)67-72-68(75-63-40-22-18-36-53(63)57-42-61-55(44-65(57)75)51-34-16-20-38-59(51)70(61,47-26-8-2-9-27-47)48-28-10-3-11-29-48)74-69(73-67)76-64-41-23-19-37-54(64)58-43-62-56(45-66(58)76)52-35-17-21-39-60(52)71(62,49-30-12-4-13-31-49)50-32-14-5-15-33-50/h2*1-46H;1-45H.
What are the key properties of 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole?
11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole has a molecular weight of 2902.55 g/mol, XLogP of 50.59, 21 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[6-(12,12-diphenylindeno[2,1-a]carbazol-11-yl)-2-phenylpyrimidin-4-yl]-12,12-diphenylindeno[2,1-a]carbazole;5-[6-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-2-phenylpyrimidin-4-yl]-11,11-diphenylindeno[1,2-b]carbazole;5-[4-(11,11-diphenylindeno[1,2-b]carbazol-5-yl)-6-phenyl-1,3,5-triazin-2-yl]-11,11-diphenylindeno[1,2-b]carbazole is sourced from PubChem (CID 159275309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).