5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole

C56H36N6 — CID 146187839

IUPAC5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccc(-c5ccc6c(c5)c5cccnc5n6-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)cc4c4ncccc43)c2)cc1
InChIInChI=1S/C56H36N6/c1-5-15-37(16-6-1)43-33-48(39-19-9-3-10-20-39)59-53(35-43)61-51-28-26-42(32-47(51)55-52(61)24-14-29-57-55)41-25-27-50-46(31-41)45-23-13-30-58-56(45)62(50)54-36-44(38-17-7-2-8-18-38)34-49(60-54)40-21-11-4-12-22-40/h1-36H
InChIKeyREBDJKRPGDJOGK-UHFFFAOYSA-N
MW792.95 g/mol
LogP13.80
Rot. Bonds7

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

5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole (PubChem CID 146187839) has the molecular formula C56H36N6 and a molecular weight of 792.95 g/mol. Its IUPAC name is 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole.

Molecular Properties

Compound Name5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole
PubChem CID146187839
Molecular FormulaC56H36N6
Molecular Weight792.95 g/mol
Exact Mass792.30
IUPAC Name5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccc(-c5ccc6c(c5)c5cccnc5n6-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)cc4c4ncccc43)c2)cc1
InChIInChI=1S/C56H36N6/c1-5-15-37(16-6-1)43-33-48(39-19-9-3-10-20-39)59-53(35-43)61-51-28-26-42(32-47(51)55-52(61)24-14-29-57-55)41-25-27-50-46(31-41)45-23-13-30-58-56(45)62(50)54-36-44(38-17-7-2-8-18-38)34-49(60-54)40-21-11-4-12-22-40/h1-36H
InChIKeyREBDJKRPGDJOGK-UHFFFAOYSA-N
XLogP13.80
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500792.95
LogP ≤ 513.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole with MolForge

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Related Compounds

5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]pyrido[3,2-b]indole;5-(4,6-diphenyl-2-pyridinyl)-8-[5-(4,6-diphenyl-2-pyridinyl)pyrido[3,2-b]indol-8-yl]pyrido[3,2-b]indole;5-(4,6-diphenyl-2-pyridinyl)-8-[5-(4,6-diphenylpyrimidin-2-yl)pyrido[3,2-b]indol-8-yl]pyrido[3,2-b]indole
CID 158303193
8-[9-(4,6-diphenyl-2-pyridinyl)carbazol-2-yl]-5-phenylpyrido[3,2-b]indole
CID 129221693
5-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-8-dibenzofuran-2-ylpyrido[3,2-b]indole;3-dibenzofuran-2-yl-9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-6-phenylcarbazole;8-dibenzofuran-2-yl-5-(4,6-diphenyl-2-pyridinyl)pyrido[3,2-b]indole
CID 161096989
5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-8-(9-phenylcarbazol-3-yl)pyrido[3,2-b]indole
CID 118587633
9-(4,6-diphenyl-2-pyridinyl)-7-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 129221619
8-[9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 118587644
3-[9-(6,9-diphenylcarbazol-3-yl)-6-phenylcarbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)-6-phenylcarbazole
CID 88866629
2-[4-[4-(9-pyridin-2-ylpyrido[2,3-b]indol-6-yl)phenyl]phenyl]-1,10-phenanthroline
CID 118403848
5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-8-(9-phenylcarbazol-3-yl)pyrido[3,2-b]indole
CID 129221991
6-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole
CID 90336618
8-[9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 118587585
9-[6-(3,6-diphenylcarbazol-9-yl)-4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-pyridinyl]-3,6-diphenylcarbazole
CID 150665244

Frequently Asked Questions

What is the IUPAC name of 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole?
The IUPAC name of 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole (CID 146187839) is 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole.
What is the SMILES notation for 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole?
The canonical SMILES for 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccc(-c5ccc6c(c5)c5cccnc5n6-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)cc4c4ncccc43)c2)cc1.
What is the InChIKey of 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole?
The InChIKey is REBDJKRPGDJOGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N6/c1-5-15-37(16-6-1)43-33-48(39-19-9-3-10-20-39)59-53(35-43)61-51-28-26-42(32-47(51)55-52(61)24-14-29-57-55)41-25-27-50-46(31-41)45-23-13-30-58-56(45)62(50)54-36-44(38-17-7-2-8-18-38)34-49(60-54)40-21-11-4-12-22-40/h1-36H.
What are the key properties of 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole?
5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole has a molecular weight of 792.95 g/mol, XLogP of 13.80, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,6-diphenyl-2-pyridinyl)-8-[9-(4,6-diphenyl-2-pyridinyl)pyrido[2,3-b]indol-6-yl]pyrido[3,2-b]indole is sourced from PubChem (CID 146187839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).