5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole

C103H67N9 — CID 159364735

About 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole

5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole (PubChem CID 159364735) has the molecular formula C103H67N9 and a molecular weight of 1430.73 g/mol. Its IUPAC name is 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole.

Molecular Properties

• Compound Name: 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole
• PubChem CID: 159364735
• Molecular Formula: C103H67N9
• Molecular Weight: 1430.73 g/mol
• Exact Mass: 1429.55
• IUPAC Name: 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole
• SMILES: c1ccc(-c2cc(-c3cccc(-n4c5ccc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc5c5ncccc54)c3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc5c5ncccc54)c3)n2)cc1
• InChI: InChI=1S/C52H34N4.C51H33N5/c1-4-15-35(16-5-1)45-33-39(34-46(54-45)36-17-6-2-7-18-36)37-19-12-22-41(31-37)56-48-29-28-38(32-44(48)52-50(56)27-14-30-53-52)42-24-13-26-49-51(42)43-23-10-11-25-47(43)55(49)40-20-8-3-9-21-40;1-4-15-34(16-5-1)43-33-44(35-17-6-2-7-18-35)54-51(53-43)37-19-12-22-39(31-37)56-46-29-28-36(32-42(46)50-48(56)27-14-30-52-50)40-24-13-26-47-49(40)41-23-10-11-25-45(41)55(47)38-20-8-3-9-21-38/h1-34H;1-33H
• InChIKey: LIZFFSRSOMDBMG-UHFFFAOYSA-N
• XLogP: 26.07
• TPSA: 84.17 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 12
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1430.73
LogP ≤ 5	26.07
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole?

The IUPAC name of 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole (CID 159364735) is 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole.

What is the SMILES notation for 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole?

The canonical SMILES for 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole is c1ccc(-c2cc(-c3cccc(-n4c5ccc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc5c5ncccc54)c3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc5c5ncccc54)c3)n2)cc1.

What is the InChIKey of 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole?

The InChIKey is LIZFFSRSOMDBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H34N4.C51H33N5/c1-4-15-35(16-5-1)45-33-39(34-46(54-45)36-17-6-2-7-18-36)37-19-12-22-41(31-37)56-48-29-28-38(32-44(48)52-50(56)27-14-30-53-52)42-24-13-26-49-51(42)43-23-10-11-25-47(43)55(49)40-20-8-3-9-21-40;1-4-15-34(16-5-1)43-33-44(35-17-6-2-7-18-35)54-51(53-43)37-19-12-22-39(31-37)56-46-29-28-36(32-42(46)50-48(56)27-14-30-52-50)40-24-13-26-47-49(40)41-23-10-11-25-45(41)55(47)38-20-8-3-9-21-38/h1-34H;1-33H.

What are the key properties of 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole?

5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole has a molecular weight of 1430.73 g/mol, XLogP of 26.07, 12 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole is sourced from PubChem (CID 159364735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).