5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole

C132H90N16 — CID 157339265

About 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole

5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole (PubChem CID 157339265) has the molecular formula C132H90N16 and a molecular weight of 1900.28 g/mol. Its IUPAC name is 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole.

Molecular Properties

• Compound Name: 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole
• PubChem CID: 157339265
• Molecular Formula: C132H90N16
• Molecular Weight: 1900.28 g/mol
• Exact Mass: 1898.75
• IUPAC Name: 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole
• SMILES: CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cn1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ncc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cn1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)C(c4ccccc4)(c4ccccc4)c4ccccc4-6)nc3)n2)cc1
• InChI: InChI=1S/C51H33N5.C41H29N5.C40H28N6/c1-5-17-34(18-6-1)48-53-49(35-19-7-2-8-20-35)55-50(54-48)36-29-30-47(52-33-36)56-45-28-16-14-26-40(45)42-31-41-39-25-13-15-27-43(39)51(44(41)32-46(42)56,37-21-9-3-10-22-37)38-23-11-4-12-24-38;1-41(2)32-19-11-9-17-29(32)30-22-23-34-36(37(30)41)31-18-10-12-20-33(31)46(34)35-24-21-28(25-42-35)40-44-38(26-13-5-3-6-14-26)43-39(45-40)27-15-7-4-8-16-27;1-40(2)31-19-11-9-17-28(31)29-21-22-33-34(35(29)40)30-18-10-12-20-32(30)46(33)39-41-23-27(24-42-39)38-44-36(25-13-5-3-6-14-25)43-37(45-38)26-15-7-4-8-16-26/h1-33H;3-25H,1-2H3;3-24H,1-2H3
• InChIKey: BGEZCDRFISFNHZ-UHFFFAOYSA-N
• XLogP: 30.46
• TPSA: 182.36 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 14
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1900.28
LogP ≤ 5	30.46
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole?

The IUPAC name of 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole (CID 157339265) is 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole.

What is the SMILES notation for 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole?

The canonical SMILES for 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole is CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cn1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ncc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cn1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)C(c4ccccc4)(c4ccccc4)c4ccccc4-6)nc3)n2)cc1.

What is the InChIKey of 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole?

The InChIKey is BGEZCDRFISFNHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H33N5.C41H29N5.C40H28N6/c1-5-17-34(18-6-1)48-53-49(35-19-7-2-8-20-35)55-50(54-48)36-29-30-47(52-33-36)56-45-28-16-14-26-40(45)42-31-41-39-25-13-15-27-43(39)51(44(41)32-46(42)56,37-21-9-3-10-22-37)38-23-11-4-12-24-38;1-41(2)32-19-11-9-17-29(32)30-22-23-34-36(37(30)41)31-18-10-12-20-33(31)46(34)35-24-21-28(25-42-35)40-44-38(26-13-5-3-6-14-26)43-39(45-40)27-15-7-4-8-16-27;1-40(2)31-19-11-9-17-28(31)29-21-22-33-34(35(29)40)30-18-10-12-20-32(30)46(33)39-41-23-27(24-42-39)38-44-36(25-13-5-3-6-14-25)43-37(45-38)26-15-7-4-8-16-26/h1-33H;3-25H,1-2H3;3-24H,1-2H3.

What are the key properties of 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole?

5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole has a molecular weight of 1900.28 g/mol, XLogP of 30.46, 14 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-7,7-diphenylindeno[2,1-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole is sourced from PubChem (CID 157339265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).