7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole

C101H65Br3N10 — CID 162259764

IUPAC7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole
SMILESBrc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccc5)cc(-c5ccccc5)n4)cc3)c2c1.Brc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)c2c1.Brc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc3)c2c1
InChIInChI=1S/2C34H22BrN3.C33H21BrN4/c35-27-15-18-29-33(22-27)38(32-12-7-19-36-34(29)32)28-16-13-23(14-17-28)26-20-30(24-8-3-1-4-9-24)37-31(21-26)25-10-5-2-6-11-25;35-27-15-18-29-33(22-27)38(32-12-7-19-36-34(29)32)28-16-13-25(14-17-28)31-21-26(23-8-3-1-4-9-23)20-30(37-31)24-10-5-2-6-11-24;34-26-11-14-28-32(21-26)38(31-8-5-17-37-33(28)31)27-12-9-22(10-13-27)23-18-24(29-6-1-3-15-35-29)20-25(19-23)30-7-2-4-16-36-30/h2*1-22H;1-21H
InChIKeyZZBRPXGLKXPRJF-UHFFFAOYSA-N
MW1658.41 g/mol
LogP27.41
Rot. Bonds12

About 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole

7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole (PubChem CID 162259764) has the molecular formula C101H65Br3N10 and a molecular weight of 1658.41 g/mol. Its IUPAC name is 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole.

Molecular Properties

Compound Name7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole
PubChem CID162259764
Molecular FormulaC101H65Br3N10
Molecular Weight1658.41 g/mol
Exact Mass1654.29
IUPAC Name7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole
SMILESBrc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccc5)cc(-c5ccccc5)n4)cc3)c2c1.Brc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)c2c1.Brc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc3)c2c1
InChIInChI=1S/2C34H22BrN3.C33H21BrN4/c35-27-15-18-29-33(22-27)38(32-12-7-19-36-34(29)32)28-16-13-23(14-17-28)26-20-30(24-8-3-1-4-9-24)37-31(21-26)25-10-5-2-6-11-25;35-27-15-18-29-33(22-27)38(32-12-7-19-36-34(29)32)28-16-13-25(14-17-28)31-21-26(23-8-3-1-4-9-23)20-30(37-31)24-10-5-2-6-11-24;34-26-11-14-28-32(21-26)38(31-8-5-17-37-33(28)31)27-12-9-22(10-13-27)23-18-24(29-6-1-3-15-35-29)20-25(19-23)30-7-2-4-16-36-30/h2*1-22H;1-21H
InChIKeyZZBRPXGLKXPRJF-UHFFFAOYSA-N
XLogP27.41
TPSA105.02 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds12
Heavy Atoms114
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001658.41
LogP ≤ 527.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole?
The IUPAC name of 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole (CID 162259764) is 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole.
What is the SMILES notation for 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole?
The canonical SMILES for 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole is Brc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccc5)cc(-c5ccccc5)n4)cc3)c2c1.Brc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)c2c1.Brc1ccc2c3ncccc3n(-c3ccc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc3)c2c1.
What is the InChIKey of 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole?
The InChIKey is ZZBRPXGLKXPRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C34H22BrN3.C33H21BrN4/c35-27-15-18-29-33(22-27)38(32-12-7-19-36-34(29)32)28-16-13-23(14-17-28)26-20-30(24-8-3-1-4-9-24)37-31(21-26)25-10-5-2-6-11-25;35-27-15-18-29-33(22-27)38(32-12-7-19-36-34(29)32)28-16-13-25(14-17-28)31-21-26(23-8-3-1-4-9-23)20-30(37-31)24-10-5-2-6-11-24;34-26-11-14-28-32(21-26)38(31-8-5-17-37-33(28)31)27-12-9-22(10-13-27)23-18-24(29-6-1-3-15-35-29)20-25(19-23)30-7-2-4-16-36-30/h2*1-22H;1-21H.
What are the key properties of 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole?
7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole has a molecular weight of 1658.41 g/mol, XLogP of 27.41, 12 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]pyrido[3,2-b]indole;7-bromo-5-[4-(3,5-dipyridin-2-ylphenyl)phenyl]pyrido[3,2-b]indole is sourced from PubChem (CID 162259764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).