8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine

C106H64N10 — CID 146379873

IUPAC8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine
SMILESc1ccc(-c2cc(-c3ccccc3-c3ccc4c(c3)ncc3cccnc34)cc(-c3ccccc3-c3ccc4c(c3)ncc3cccnc34)c2)c(-c2ccc(-c3ccc(-c4ccccc4-c4cc(-c5ccccc5-c5ccc6c(c5)ncc5cccnc56)cc(-c5ccccc5-c5ccc6c(c5)ncc5cccnc56)c4)cn3)nc2)c1
InChIInChI=1S/C106H64N10/c1-7-27-87(81(21-1)65-33-39-93-99(55-65)113-61-71-17-13-45-107-103(71)93)75-49-76(88-28-8-2-22-82(88)66-34-40-94-100(56-66)114-62-72-18-14-46-108-104(72)94)52-79(51-75)91-31-11-5-25-85(91)69-37-43-97(111-59-69)98-44-38-70(60-112-98)86-26-6-12-32-92(86)80-53-77(89-29-9-3-23-83(89)67-35-41-95-101(57-67)115-63-73-19-15-47-109-105(73)95)50-78(54-80)90-30-10-4-24-84(90)68-36-42-96-102(58-68)116-64-74-20-16-48-110-106(74)96/h1-64H
InChIKeyCRQMXPYOGNLVLO-UHFFFAOYSA-N
MW1477.75 g/mol
LogP26.53
Rot. Bonds13

About 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine

8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine (PubChem CID 146379873) has the molecular formula C106H64N10 and a molecular weight of 1477.75 g/mol. Its IUPAC name is 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine.

Molecular Properties

Compound Name8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine
PubChem CID146379873
Molecular FormulaC106H64N10
Molecular Weight1477.75 g/mol
Exact Mass1476.53
IUPAC Name8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine
SMILESc1ccc(-c2cc(-c3ccccc3-c3ccc4c(c3)ncc3cccnc34)cc(-c3ccccc3-c3ccc4c(c3)ncc3cccnc34)c2)c(-c2ccc(-c3ccc(-c4ccccc4-c4cc(-c5ccccc5-c5ccc6c(c5)ncc5cccnc56)cc(-c5ccccc5-c5ccc6c(c5)ncc5cccnc56)c4)cn3)nc2)c1
InChIInChI=1S/C106H64N10/c1-7-27-87(81(21-1)65-33-39-93-99(55-65)113-61-71-17-13-45-107-103(71)93)75-49-76(88-28-8-2-22-82(88)66-34-40-94-100(56-66)114-62-72-18-14-46-108-104(72)94)52-79(51-75)91-31-11-5-25-85(91)69-37-43-97(111-59-69)98-44-38-70(60-112-98)86-26-6-12-32-92(86)80-53-77(89-29-9-3-23-83(89)67-35-41-95-101(57-67)115-63-73-19-15-47-109-105(73)95)50-78(54-80)90-30-10-4-24-84(90)68-36-42-96-102(58-68)116-64-74-20-16-48-110-106(74)96/h1-64H
InChIKeyCRQMXPYOGNLVLO-UHFFFAOYSA-N
XLogP26.53
TPSA128.90 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds13
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001477.75
LogP ≤ 526.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine with MolForge

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Related Compounds

14-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-9,9-dimethyl-3-azatricyclo[10.4.0.02,7]hexadeca-1(12),2(7),3,5,13,15-hexaene
CID 145132313
6-[3-[3-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]benzo[h]quinoline;7-[3-[3-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]benzo[h]quinoline;3-[3-[3-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenanthridine
CID 158599286
3-[6-[3-(4-phenylphenyl)-5-quinolin-8-ylphenyl]-3-pyridinyl]-1,10-phenanthroline
CID 171459977
2-phenyl-5-[2-[3-[2-(6-phenyl-3-pyridinyl)phenyl]-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]pyridine
CID 122487708
5-anthracen-1-yl-2-pyridin-2-ylpyridine
CID 58813785
4-[4-[4-[3,5-bis(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]phenyl]-2-phenyl-1,10-phenanthroline
CID 155336923
7-[3-[3-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]benzo[h]quinoline
CID 153156483
3-[5-(3-dibenzothiophen-4-yl-5-quinolin-3-ylphenyl)-2-pyridinyl]-1,10-phenanthroline
CID 171459979
8-[6-[4-phenyl-6-[3-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]-1,3,5-triazin-2-yl]-3-pyridinyl]quinoline
CID 171749073
7-(3,5-diphenylphenyl)benzo[h]quinoline
CID 140719025
8-[6-[4-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-3-pyridinyl]quinoline
CID 129265610
2-(3-benzo[g]quinolin-2-yl-5-quinolin-8-ylphenyl)benzo[g]quinoline
CID 139364035

Frequently Asked Questions

What is the IUPAC name of 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine?
The IUPAC name of 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine (CID 146379873) is 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine.
What is the SMILES notation for 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine?
The canonical SMILES for 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine is c1ccc(-c2cc(-c3ccccc3-c3ccc4c(c3)ncc3cccnc34)cc(-c3ccccc3-c3ccc4c(c3)ncc3cccnc34)c2)c(-c2ccc(-c3ccc(-c4ccccc4-c4cc(-c5ccccc5-c5ccc6c(c5)ncc5cccnc56)cc(-c5ccccc5-c5ccc6c(c5)ncc5cccnc56)c4)cn3)nc2)c1.
What is the InChIKey of 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine?
The InChIKey is CRQMXPYOGNLVLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C106H64N10/c1-7-27-87(81(21-1)65-33-39-93-99(55-65)113-61-71-17-13-45-107-103(71)93)75-49-76(88-28-8-2-22-82(88)66-34-40-94-100(56-66)114-62-72-18-14-46-108-104(72)94)52-79(51-75)91-31-11-5-25-85(91)69-37-43-97(111-59-69)98-44-38-70(60-112-98)86-26-6-12-32-92(86)80-53-77(89-29-9-3-23-83(89)67-35-41-95-101(57-67)115-63-73-19-15-47-109-105(73)95)50-78(54-80)90-30-10-4-24-84(90)68-36-42-96-102(58-68)116-64-74-20-16-48-110-106(74)96/h1-64H.
What are the key properties of 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine?
8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine has a molecular weight of 1477.75 g/mol, XLogP of 26.53, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[3-(2-benzo[h][1,6]naphthyridin-8-ylphenyl)-5-[2-[6-[5-[2-[3,5-bis(2-benzo[h][1,6]naphthyridin-8-ylphenyl)phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]phenyl]phenyl]benzo[h][1,6]naphthyridine is sourced from PubChem (CID 146379873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).