9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole

C66H42N2 — CID 155333252

IUPAC9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole
SMILESc1ccc(-c2cc3ccccc3cc2-c2c3cccc(-c4cccc5c4c4ccccc4n5-c4ccccc4)c3cc3c(-c4cccc5c4c4ccccc4n5-c4ccccc4)cccc23)cc1
InChIInChI=1S/C66H42N2/c1-4-20-43(21-5-1)56-40-44-22-10-11-23-45(44)41-59(56)64-52-32-16-30-48(50-34-18-38-62-65(50)54-28-12-14-36-60(54)67(62)46-24-6-2-7-25-46)57(52)42-58-49(31-17-33-53(58)64)51-35-19-39-63-66(51)55-29-13-15-37-61(55)68(63)47-26-8-3-9-27-47/h1-42H
InChIKeyZRJMOVVSQLSEDP-UHFFFAOYSA-N
MW863.08 g/mol
LogP18.01
Rot. Bonds6

About 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole

9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole (PubChem CID 155333252) has the molecular formula C66H42N2 and a molecular weight of 863.08 g/mol. Its IUPAC name is 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole.

Molecular Properties

Compound Name9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole
PubChem CID155333252
Molecular FormulaC66H42N2
Molecular Weight863.08 g/mol
Exact Mass862.33
IUPAC Name9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole
SMILESc1ccc(-c2cc3ccccc3cc2-c2c3cccc(-c4cccc5c4c4ccccc4n5-c4ccccc4)c3cc3c(-c4cccc5c4c4ccccc4n5-c4ccccc4)cccc23)cc1
InChIInChI=1S/C66H42N2/c1-4-20-43(21-5-1)56-40-44-22-10-11-23-45(44)41-59(56)64-52-32-16-30-48(50-34-18-38-62-65(50)54-28-12-14-36-60(54)67(62)46-24-6-2-7-25-46)57(52)42-58-49(31-17-33-53(58)64)51-35-19-39-63-66(51)55-29-13-15-37-61(55)68(63)47-26-8-3-9-27-47/h1-42H
InChIKeyZRJMOVVSQLSEDP-UHFFFAOYSA-N
XLogP18.01
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500863.08
LogP ≤ 518.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole 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

9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(5-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole
CID 155333113
4-[10-(2,4-diphenylphenyl)-8-(9-phenylcarbazol-4-yl)anthracen-1-yl]-9-phenylcarbazole
CID 155334200
9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(7-phenylnaphthalen-1-yl)anthracen-1-yl]carbazole
CID 155333886
4-(9-naphthalen-2-ylcarbazol-4-yl)-9-phenylcarbazole
CID 134507252
9-phenyl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]carbazole
CID 134391811
9-[4,5-bis(9-phenylcarbazol-4-yl)anthracen-9-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaene
CID 155333620
9-(3,4-diphenylphenyl)-4-[9-(3,4-diphenylphenyl)carbazol-4-yl]carbazole
CID 165386118
5-naphthalen-1-yl-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 134369788
3-[10-(4,5-diphenylanthracen-9-yl)-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]-9-phenylcarbazole
CID 155333594
4-benzo[c]phenanthren-5-yl-9-phenylcarbazole
CID 121287474
5-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]naphtho[2,3-c]carbazole
CID 164740453
4-[10-(9,9-dimethylfluoren-2-yl)-8-(9-phenylcarbazol-4-yl)anthracen-1-yl]-9-phenylcarbazole
CID 155334819

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole?
The IUPAC name of 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole (CID 155333252) is 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole.
What is the SMILES notation for 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole?
The canonical SMILES for 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole is c1ccc(-c2cc3ccccc3cc2-c2c3cccc(-c4cccc5c4c4ccccc4n5-c4ccccc4)c3cc3c(-c4cccc5c4c4ccccc4n5-c4ccccc4)cccc23)cc1.
What is the InChIKey of 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole?
The InChIKey is ZRJMOVVSQLSEDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H42N2/c1-4-20-43(21-5-1)56-40-44-22-10-11-23-45(44)41-59(56)64-52-32-16-30-48(50-34-18-38-62-65(50)54-28-12-14-36-60(54)67(62)46-24-6-2-7-25-46)57(52)42-58-49(31-17-33-53(58)64)51-35-19-39-63-66(51)55-29-13-15-37-61(55)68(63)47-26-8-3-9-27-47/h1-42H.
What are the key properties of 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole?
9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole has a molecular weight of 863.08 g/mol, XLogP of 18.01, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-4-[8-(9-phenylcarbazol-4-yl)-10-(3-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole is sourced from PubChem (CID 155333252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).