5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene

C234H195N5 — CID 160646267

About 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene

5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene (PubChem CID 160646267) has the molecular formula C234H195N5 and a molecular weight of 3077.17 g/mol. Its IUPAC name is 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene.

Molecular Properties

• Compound Name: 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene
• PubChem CID: 160646267
• Molecular Formula: C234H195N5
• Molecular Weight: 3077.17 g/mol
• Exact Mass: 3074.54
• IUPAC Name: 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene
• SMILES: CC1(C)c2ccc(-c3cccc(-c4cc(-c5ccccc5)cc(-c5cccc(-c6ccccc6)c5)c4)c3)cc2-c2cc3c4cc5c(cc4n(-c4nc(-c6ccccc6)nc(-c6ccccc6)n4)c3cc21)C(C)(C)c1ccc(-c2cccc(-c3cc(-c4ccccc4)cc(-c4cccc(-c6ccccc6)c4)c3)c2)cc1-5.Cc1cc(C(C)(C)C)cc(C)c1-c1cccc(-c2cc(-c3cccc(-c4cccc(-c5cc(-c6cccc(-c7cc(-c8cccc(-c9c(C)cc(C(C)(C)C)cc9C)c8)cc(-c8cccc(-c9c(C)cc(C(C)(C)C)cc9C)c8)c7)c6)cc(-n6c7ccccc7c7cc8c(cc76)C(C)(C)c6ccccc6-8)c5)c4)c3)cc(-c3cccc(-c4c(C)cc(C(C)(C)C)cc4C)c3)c2)c1
• InChI: InChI=1S/C129H121N.C105H74N4/c1-78-52-108(125(9,10)11)53-79(2)121(78)96-44-30-40-92(63-96)102-67-100(68-103(71-102)93-41-31-45-97(64-93)122-80(3)54-109(55-81(122)4)126(12,13)14)88-36-27-34-86(60-88)87-35-28-38-90(61-87)106-73-107(75-112(74-106)130-119-51-26-24-49-114(119)116-76-115-113-48-23-25-50-117(113)129(21,22)118(115)77-120(116)130)91-39-29-37-89(62-91)101-69-104(94-42-32-46-98(65-94)123-82(5)56-110(57-83(123)6)127(15,16)17)72-105(70-101)95-43-33-47-99(66-95)124-84(7)58-111(59-85(124)8)128(18,19)20;1-104(2)95-49-47-81(75-41-25-45-79(53-75)87-57-83(69-31-15-7-16-32-69)55-85(59-87)77-43-23-39-73(51-77)67-27-11-5-12-28-67)61-89(95)91-63-93-94-64-92-90-62-82(76-42-26-46-80(54-76)88-58-84(70-33-17-8-18-34-70)56-86(60-88)78-44-24-40-74(52-78)68-29-13-6-14-30-68)48-50-96(90)105(3,4)98(92)66-100(94)109(99(93)65-97(91)104)103-107-101(71-35-19-9-20-36-71)106-102(108-103)72-37-21-10-22-38-72/h23-77H,1-22H3;5-66H,1-4H3
• InChIKey: RJVBOIDVSIXPGR-UHFFFAOYSA-N
• XLogP: 64.00
• TPSA: 48.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 27
• Heavy Atoms: 239
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	3077.17
LogP ≤ 5	64.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene?

The IUPAC name of 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene (CID 160646267) is 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene.

What is the SMILES notation for 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene?

The canonical SMILES for 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene is CC1(C)c2ccc(-c3cccc(-c4cc(-c5ccccc5)cc(-c5cccc(-c6ccccc6)c5)c4)c3)cc2-c2cc3c4cc5c(cc4n(-c4nc(-c6ccccc6)nc(-c6ccccc6)n4)c3cc21)C(C)(C)c1ccc(-c2cccc(-c3cc(-c4ccccc4)cc(-c4cccc(-c6ccccc6)c4)c3)c2)cc1-5.Cc1cc(C(C)(C)C)cc(C)c1-c1cccc(-c2cc(-c3cccc(-c4cccc(-c5cc(-c6cccc(-c7cc(-c8cccc(-c9c(C)cc(C(C)(C)C)cc9C)c8)cc(-c8cccc(-c9c(C)cc(C(C)(C)C)cc9C)c8)c7)c6)cc(-n6c7ccccc7c7cc8c(cc76)C(C)(C)c6ccccc6-8)c5)c4)c3)cc(-c3cccc(-c4c(C)cc(C(C)(C)C)cc4C)c3)c2)c1.

What is the InChIKey of 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene?

The InChIKey is RJVBOIDVSIXPGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C129H121N.C105H74N4/c1-78-52-108(125(9,10)11)53-79(2)121(78)96-44-30-40-92(63-96)102-67-100(68-103(71-102)93-41-31-45-97(64-93)122-80(3)54-109(55-81(122)4)126(12,13)14)88-36-27-34-86(60-88)87-35-28-38-90(61-87)106-73-107(75-112(74-106)130-119-51-26-24-49-114(119)116-76-115-113-48-23-25-50-117(113)129(21,22)118(115)77-120(116)130)91-39-29-37-89(62-91)101-69-104(94-42-32-46-98(65-94)123-82(5)56-110(57-83(123)6)127(15,16)17)72-105(70-101)95-43-33-47-99(66-95)124-84(7)58-111(59-85(124)8)128(18,19)20;1-104(2)95-49-47-81(75-41-25-45-79(53-75)87-57-83(69-31-15-7-16-32-69)55-85(59-87)77-43-23-39-73(51-77)67-27-11-5-12-28-67)61-89(95)91-63-93-94-64-92-90-62-82(76-42-26-46-80(54-76)88-58-84(70-33-17-8-18-34-70)56-86(60-88)78-44-24-40-74(52-78)68-29-13-6-14-30-68)48-50-96(90)105(3,4)98(92)66-100(94)109(99(93)65-97(91)104)103-107-101(71-35-19-9-20-36-71)106-102(108-103)72-37-21-10-22-38-72/h23-77H,1-22H3;5-66H,1-4H3.

What are the key properties of 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene?

5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene has a molecular weight of 3077.17 g/mol, XLogP of 64.00, 27 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]-5-[3-[3-[3,5-bis[3-(4-tert-butyl-2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;15-(4,6-diphenyl-1,3,5-triazin-2-yl)-11,11,19,19-tetramethyl-7,23-bis[3-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5(10),6,8,13,16,18(26),20(25),21,23-dodecaene is sourced from PubChem (CID 160646267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).