5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole

C168H120N12 — CID 158120881

IUPAC5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole
SMILESCC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)n2)cc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)nc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)c3)n2)cc1
InChIInChI=1S/2C84H60N6/c1-82(2)64-28-13-7-22-55(64)58-42-45-70-73(76(58)82)61-25-10-16-31-67(61)88(70)52-38-34-49(35-39-52)79-85-80(50-36-40-53(41-37-50)89-68-32-17-11-26-62(68)74-71(89)46-43-59-56-23-8-14-29-65(56)83(3,4)77(59)74)87-81(86-79)51-20-19-21-54(48-51)90-69-33-18-12-27-63(69)75-72(90)47-44-60-57-24-9-15-30-66(57)84(5,6)78(60)75;1-82(2)64-25-13-7-19-55(64)58-43-46-70-73(76(58)82)61-22-10-16-28-67(61)88(70)52-37-31-49(32-38-52)79-85-80(50-33-39-53(40-34-50)89-68-29-17-11-23-62(68)74-71(89)47-44-59-56-20-8-14-26-65(56)83(3,4)77(59)74)87-81(86-79)51-35-41-54(42-36-51)90-69-30-18-12-24-63(69)75-72(90)48-45-60-57-21-9-15-27-66(57)84(5,6)78(60)75/h2*7-48H,1-6H3
InChIKeyFROYQDIJHMLMNJ-UHFFFAOYSA-N
MW2306.89 g/mol
LogP42.17
Rot. Bonds12

About 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole

5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole (PubChem CID 158120881) has the molecular formula C168H120N12 and a molecular weight of 2306.89 g/mol. Its IUPAC name is 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole.

Molecular Properties

Compound Name5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole
PubChem CID158120881
Molecular FormulaC168H120N12
Molecular Weight2306.89 g/mol
Exact Mass2304.98
IUPAC Name5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole
SMILESCC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)n2)cc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)nc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)c3)n2)cc1
InChIInChI=1S/2C84H60N6/c1-82(2)64-28-13-7-22-55(64)58-42-45-70-73(76(58)82)61-25-10-16-31-67(61)88(70)52-38-34-49(35-39-52)79-85-80(50-36-40-53(41-37-50)89-68-32-17-11-26-62(68)74-71(89)46-43-59-56-23-8-14-29-65(56)83(3,4)77(59)74)87-81(86-79)51-20-19-21-54(48-51)90-69-33-18-12-27-63(69)75-72(90)47-44-60-57-24-9-15-30-66(57)84(5,6)78(60)75;1-82(2)64-25-13-7-19-55(64)58-43-46-70-73(76(58)82)61-22-10-16-28-67(61)88(70)52-37-31-49(32-38-52)79-85-80(50-33-39-53(40-34-50)89-68-29-17-11-23-62(68)74-71(89)47-44-59-56-20-8-14-26-65(56)83(3,4)77(59)74)87-81(86-79)51-35-41-54(42-36-51)90-69-30-18-12-24-63(69)75-72(90)48-45-60-57-21-9-15-27-66(57)84(5,6)78(60)75/h2*7-48H,1-6H3
InChIKeyFROYQDIJHMLMNJ-UHFFFAOYSA-N
XLogP42.17
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms180
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002306.89
LogP ≤ 542.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole?
The IUPAC name of 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole (CID 158120881) is 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole.
What is the SMILES notation for 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole?
The canonical SMILES for 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole is CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)n2)cc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)cc3)nc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)c3)n2)cc1.
What is the InChIKey of 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole?
The InChIKey is FROYQDIJHMLMNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C84H60N6/c1-82(2)64-28-13-7-22-55(64)58-42-45-70-73(76(58)82)61-25-10-16-31-67(61)88(70)52-38-34-49(35-39-52)79-85-80(50-36-40-53(41-37-50)89-68-32-17-11-26-62(68)74-71(89)46-43-59-56-23-8-14-29-65(56)83(3,4)77(59)74)87-81(86-79)51-20-19-21-54(48-51)90-69-33-18-12-27-63(69)75-72(90)47-44-60-57-24-9-15-30-66(57)84(5,6)78(60)75;1-82(2)64-25-13-7-19-55(64)58-43-46-70-73(76(58)82)61-22-10-16-28-67(61)88(70)52-37-31-49(32-38-52)79-85-80(50-33-39-53(40-34-50)89-68-29-17-11-23-62(68)74-71(89)47-44-59-56-20-8-14-26-65(56)83(3,4)77(59)74)87-81(86-79)51-35-41-54(42-36-51)90-69-30-18-12-24-63(69)75-72(90)48-45-60-57-21-9-15-27-66(57)84(5,6)78(60)75/h2*7-48H,1-6H3.
What are the key properties of 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole?
5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole has a molecular weight of 2306.89 g/mol, XLogP of 42.17, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole is sourced from PubChem (CID 158120881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).