2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole

C58H37N — CID 144756284

IUPAC2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole
SMILESc1ccc2cc(-n3c(-c4ccc(-c5ccc6c(-c7cccc8ccccc78)c7ccccc7c(-c7cccc8ccccc78)c6c5)cc4)cc4ccccc43)ccc2c1
InChIInChI=1S/C58H37N/c1-2-16-43-35-46(33-31-38(43)13-1)59-55-26-10-5-17-45(55)37-56(59)42-29-27-39(28-30-42)44-32-34-53-54(36-44)58(50-25-12-19-41-15-4-7-21-48(41)50)52-23-9-8-22-51(52)57(53)49-24-11-18-40-14-3-6-20-47(40)49/h1-37H
InChIKeySUWGFCGNVOQKBG-UHFFFAOYSA-N
MW747.94 g/mol
LogP16.06
Rot. Bonds5

About 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole

2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole (PubChem CID 144756284) has the molecular formula C58H37N and a molecular weight of 747.94 g/mol. Its IUPAC name is 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole.

Molecular Properties

Compound Name2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole
PubChem CID144756284
Molecular FormulaC58H37N
Molecular Weight747.94 g/mol
Exact Mass747.29
IUPAC Name2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole
SMILESc1ccc2cc(-n3c(-c4ccc(-c5ccc6c(-c7cccc8ccccc78)c7ccccc7c(-c7cccc8ccccc78)c6c5)cc4)cc4ccccc43)ccc2c1
InChIInChI=1S/C58H37N/c1-2-16-43-35-46(33-31-38(43)13-1)59-55-26-10-5-17-45(55)37-56(59)42-29-27-39(28-30-42)44-32-34-53-54(36-44)58(50-25-12-19-41-15-4-7-21-48(41)50)52-23-9-8-22-51(52)57(53)49-24-11-18-40-14-3-6-20-47(40)49/h1-37H
InChIKeySUWGFCGNVOQKBG-UHFFFAOYSA-N
XLogP16.06
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500747.94
LogP ≤ 516.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole 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

10-naphthalen-1-yl-2-naphthalen-2-yl-9-(4-naphthalen-2-ylphenyl)anthracene
CID 58193908
9-naphthalen-1-yl-2,6-dinaphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 159201170
2-[7-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenanthren-2-yl]-1-phenylindole
CID 144756297
10-naphthalen-1-yl-9-(4-naphthalen-2-ylphenyl)-2-phenylanthracene
CID 58322799
10-naphthalen-1-yl-9-naphthalen-2-yl-2-(4-phenylphenyl)anthracene
CID 59766348
9-naphthalen-1-yl-10-naphthalen-2-yl-2,6-diphenylanthracene
CID 123330330
9-naphthalen-1-yl-2-naphthalen-2-yl-10-(2-naphthalen-2-ylphenyl)anthracene
CID 58323226
7-naphthalen-2-yl-2-(7-naphthalen-1-ylnaphthalen-2-yl)benzo[c]carbazole
CID 130351413
9,10-dinaphthalen-1-yl-2-phenylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;10-naphthalen-1-yl-2-naphthalen-2-yl-9-phenylanthracene;9-naphthalen-1-yl-2-phenyl-10-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenyl-10-(4-phenylphenyl)anthracene;2-phenyl-9,10-bis(4-phenylphenyl)anthracene
CID 161337169
6-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-2-[9-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420566
9-(3,5-dinaphthalen-1-ylphenyl)-10-naphthalen-1-yl-2-naphthalen-2-ylanthracene
CID 58323614
9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)carbazole
CID 177074694

Frequently Asked Questions

What is the IUPAC name of 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole?
The IUPAC name of 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole (CID 144756284) is 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole.
What is the SMILES notation for 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole?
The canonical SMILES for 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole is c1ccc2cc(-n3c(-c4ccc(-c5ccc6c(-c7cccc8ccccc78)c7ccccc7c(-c7cccc8ccccc78)c6c5)cc4)cc4ccccc43)ccc2c1.
What is the InChIKey of 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole?
The InChIKey is SUWGFCGNVOQKBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H37N/c1-2-16-43-35-46(33-31-38(43)13-1)59-55-26-10-5-17-45(55)37-56(59)42-29-27-39(28-30-42)44-32-34-53-54(36-44)58(50-25-12-19-41-15-4-7-21-48(41)50)52-23-9-8-22-51(52)57(53)49-24-11-18-40-14-3-6-20-47(40)49/h1-37H.
What are the key properties of 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole?
2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole has a molecular weight of 747.94 g/mol, XLogP of 16.06, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-naphthalen-2-ylindole is sourced from PubChem (CID 144756284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).