5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine

C66H46N4 — CID 59219916

IUPAC5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine
SMILESCN1c2ccccc2N(c2ccc3c(-c4ccc5ccccc5c4)c4cc(N5c6ccccc6N(C)c6ccccc65)ccc4c(-c4cccc(-c5cccc6ccccc56)c4)c3c2)c2ccccc21
InChIInChI=1S/C66H46N4/c1-67-57-25-7-11-29-61(57)69(62-30-12-8-26-58(62)67)49-36-38-54-55(41-49)65(47-22-15-21-46(40-47)52-24-16-20-44-18-5-6-23-51(44)52)53-37-35-50(42-56(53)66(54)48-34-33-43-17-3-4-19-45(43)39-48)70-63-31-13-9-27-59(63)68(2)60-28-10-14-32-64(60)70/h3-42H,1-2H3
InChIKeyFTVZDQHXOSQULG-UHFFFAOYSA-N
MW895.12 g/mol
LogP18.40
Rot. Bonds5

About 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine

5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine (PubChem CID 59219916) has the molecular formula C66H46N4 and a molecular weight of 895.12 g/mol. Its IUPAC name is 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine.

Molecular Properties

Compound Name5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine
PubChem CID59219916
Molecular FormulaC66H46N4
Molecular Weight895.12 g/mol
Exact Mass894.37
IUPAC Name5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine
SMILESCN1c2ccccc2N(c2ccc3c(-c4ccc5ccccc5c4)c4cc(N5c6ccccc6N(C)c6ccccc65)ccc4c(-c4cccc(-c5cccc6ccccc56)c4)c3c2)c2ccccc21
InChIInChI=1S/C66H46N4/c1-67-57-25-7-11-29-61(57)69(62-30-12-8-26-58(62)67)49-36-38-54-55(41-49)65(47-22-15-21-46(40-47)52-24-16-20-44-18-5-6-23-51(44)52)53-37-35-50(42-56(53)66(54)48-34-33-43-17-3-4-19-45(43)39-48)70-63-31-13-9-27-59(63)68(2)60-28-10-14-32-64(60)70/h3-42H,1-2H3
InChIKeyFTVZDQHXOSQULG-UHFFFAOYSA-N
XLogP18.40
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500895.12
LogP ≤ 518.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

5-methyl-10-[6-(10-methylphenazin-5-yl)-9-(3-naphthalen-2-ylphenyl)-10-phenylanthracen-2-yl]phenazine
CID 59220088
5-[6-(10,10-dimethylbenzo[b][1,4]benzazasilin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]-10,10-dimethylbenzo[b][1,4]benzazasiline
CID 59220514
5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-phenylanthracen-2-yl]phenazine
CID 59220247
5-[9-(9,9-dimethylfluoren-2-yl)-6-(10-methylphenazin-5-yl)-10-(4-naphthalen-1-ylphenyl)anthracen-2-yl]-10-methylphenazine
CID 59220680
2-naphthalen-1-yl-9,10-bis(3-naphthalen-2-ylphenyl)anthracene
CID 58322960
2-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)-9-(3-naphthalen-2-ylphenyl)anthracene
CID 58323030
2-naphthalen-1-yl-10-naphthalen-2-yl-9-(3-naphthalen-2-ylphenyl)anthracene
CID 58322767
10-(9-naphthalen-1-yl-10-naphthalen-2-yl-6-phenoxazin-10-ylanthracen-2-yl)phenoxazine
CID 59219996
10-[6-(9,9-dimethylacridin-10-yl)-9-naphthalen-1-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]-9,9-dimethylacridine
CID 59219699
11-[6-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-9-naphthalen-1-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]-5,6-dihydrobenzo[b][1]benzazepine
CID 59220351
2,9-dinaphthalen-1-yl-10-(3-naphthalen-2-ylphenyl)anthracene
CID 58323142
2,6-dinaphthalen-1-yl-9-naphthalen-2-yl-10-(3-phenylphenyl)anthracene
CID 159640682

Frequently Asked Questions

What is the IUPAC name of 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine?
The IUPAC name of 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine (CID 59219916) is 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine.
What is the SMILES notation for 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine?
The canonical SMILES for 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine is CN1c2ccccc2N(c2ccc3c(-c4ccc5ccccc5c4)c4cc(N5c6ccccc6N(C)c6ccccc65)ccc4c(-c4cccc(-c5cccc6ccccc56)c4)c3c2)c2ccccc21.
What is the InChIKey of 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine?
The InChIKey is FTVZDQHXOSQULG-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H46N4/c1-67-57-25-7-11-29-61(57)69(62-30-12-8-26-58(62)67)49-36-38-54-55(41-49)65(47-22-15-21-46(40-47)52-24-16-20-44-18-5-6-23-51(44)52)53-37-35-50(42-56(53)66(54)48-34-33-43-17-3-4-19-45(43)39-48)70-63-31-13-9-27-59(63)68(2)60-28-10-14-32-64(60)70/h3-42H,1-2H3.
What are the key properties of 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine?
5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine has a molecular weight of 895.12 g/mol, XLogP of 18.40, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-10-[6-(10-methylphenazin-5-yl)-9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracen-2-yl]phenazine is sourced from PubChem (CID 59219916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).