2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene

C60H38S — CID 58876046

IUPAC2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene
SMILESc1ccc(-c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccc6cc(-c7c8ccccc8c(-c8ccccc8)c8ccccc78)ccc6c5)c5ccccc45)c3)s2)cc1
InChIInChI=1S/C60H38S/c1-3-16-39(17-4-1)55-34-35-56(61-55)43-20-15-21-44(38-43)58-51-26-11-13-28-53(51)60(54-29-14-12-27-52(54)58)46-33-31-41-36-45(32-30-42(41)37-46)59-49-24-9-7-22-47(49)57(40-18-5-2-6-19-40)48-23-8-10-25-50(48)59/h1-38H
InChIKeyFOSFEHAULKQSBU-UHFFFAOYSA-N
MW791.03 g/mol
LogP17.52
Rot. Bonds6

About 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene

2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene (PubChem CID 58876046) has the molecular formula C60H38S and a molecular weight of 791.03 g/mol. Its IUPAC name is 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene.

Molecular Properties

Compound Name2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene
PubChem CID58876046
Molecular FormulaC60H38S
Molecular Weight791.03 g/mol
Exact Mass790.27
IUPAC Name2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene
SMILESc1ccc(-c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccc6cc(-c7c8ccccc8c(-c8ccccc8)c8ccccc78)ccc6c5)c5ccccc45)c3)s2)cc1
InChIInChI=1S/C60H38S/c1-3-16-39(17-4-1)55-34-35-56(61-55)43-20-15-21-44(38-43)58-51-26-11-13-28-53(51)60(54-29-14-12-27-52(54)58)46-33-31-41-36-45(32-30-42(41)37-46)59-49-24-9-7-22-47(49)57(40-18-5-2-6-19-40)48-23-8-10-25-50(48)59/h1-38H
InChIKeyFOSFEHAULKQSBU-UHFFFAOYSA-N
XLogP17.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500791.03
LogP ≤ 517.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-[10-[6-[10-(6-methylnaphthalen-2-yl)anthracen-9-yl]naphthalen-2-yl]anthracen-9-yl]phenyl]-5-phenylthiophene
CID 58876218
2-[4-[2-(10-naphthalen-2-ylanthracen-9-yl)-10-[4-(5-phenylthiophen-2-yl)phenyl]anthracen-9-yl]phenyl]-5-phenylthiophene
CID 58963498
2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-(10-phenylanthracen-9-yl)thiophene
CID 58963478
9-(3-phenylphenyl)-10-[6-[10-(3-phenylphenyl)anthracen-9-yl]naphthalen-2-yl]anthracene
CID 153438367
9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene
CID 58151267
9-naphthalen-2-yl-10-[7-[7-[3-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]naphthalen-2-yl]anthracene
CID 172546693
9-(3-naphthalen-2-ylphenyl)-10-[4-(4-phenylphenyl)phenyl]anthracene
CID 144568868
9-(4-naphthalen-2-ylphenyl)-10-[3-(3-phenylphenyl)phenyl]anthracene
CID 144568832
9-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 58876197
methane;2-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-5-phenylthiophene;2-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylthiophene;2-naphthalen-1-yl-5-[2-(10-naphthalen-1-ylanthracen-9-yl)-4-(5-naphthalen-1-ylthiophen-2-yl)phenyl]thiophene
CID 157364267
9-[3-(3,5-diphenylphenyl)phenyl]-10-[4-(3-naphthalen-2-ylphenyl)phenyl]anthracene
CID 59798540
9-(3-anthracen-2-ylphenyl)-10-(4-phenylphenyl)anthracene
CID 164706350

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene?
The IUPAC name of 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene (CID 58876046) is 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene.
What is the SMILES notation for 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene?
The canonical SMILES for 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene is c1ccc(-c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccc6cc(-c7c8ccccc8c(-c8ccccc8)c8ccccc78)ccc6c5)c5ccccc45)c3)s2)cc1.
What is the InChIKey of 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene?
The InChIKey is FOSFEHAULKQSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H38S/c1-3-16-39(17-4-1)55-34-35-56(61-55)43-20-15-21-44(38-43)58-51-26-11-13-28-53(51)60(54-29-14-12-27-52(54)58)46-33-31-41-36-45(32-30-42(41)37-46)59-49-24-9-7-22-47(49)57(40-18-5-2-6-19-40)48-23-8-10-25-50(48)59/h1-38H.
What are the key properties of 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene?
2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene has a molecular weight of 791.03 g/mol, XLogP of 17.52, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-[3-[10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]thiophene is sourced from PubChem (CID 58876046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).