N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine

C136H88N8 — CID 161402037

IUPACN-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine
SMILESc1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccccc4-c4ccc5cccnc5c4)c4ccccc4c(-c4ccccc4-c4ccc5cccnc5c4)c3c2)cc1.c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3c(-c4ccccc4-c4ccc5cccnc5c4)c4ccccc4c(-c4ccccc4-c4ccc5cccnc5c4)c23)cc1
InChIInChI=1S/2C68H44N4/c1-2-19-49(20-3-1)71(50-37-39-51(40-38-50)72-63-30-12-10-23-54(63)55-24-11-13-31-64(55)72)65-32-14-29-60-66(56-25-6-4-21-52(56)47-35-33-45-17-15-41-69-61(45)43-47)58-27-8-9-28-59(58)67(68(60)65)57-26-7-5-22-53(57)48-36-34-46-18-16-42-70-62(46)44-48;1-2-18-49(19-3-1)71(50-34-36-51(37-35-50)72-65-28-12-10-22-55(65)56-23-11-13-29-66(56)72)52-38-39-61-62(44-52)68(58-25-7-5-21-54(58)48-33-31-46-17-15-41-70-64(46)43-48)60-27-9-8-26-59(60)67(61)57-24-6-4-20-53(57)47-32-30-45-16-14-40-69-63(45)42-47/h2*1-44H
InChIKeyVUIZZZXVZATMNI-UHFFFAOYSA-N
MW1834.26 g/mol
LogP36.65
Rot. Bonds16

About N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine

N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine (PubChem CID 161402037) has the molecular formula C136H88N8 and a molecular weight of 1834.26 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine
PubChem CID161402037
Molecular FormulaC136H88N8
Molecular Weight1834.26 g/mol
Exact Mass1832.71
IUPAC NameN-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine
SMILESc1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccccc4-c4ccc5cccnc5c4)c4ccccc4c(-c4ccccc4-c4ccc5cccnc5c4)c3c2)cc1.c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3c(-c4ccccc4-c4ccc5cccnc5c4)c4ccccc4c(-c4ccccc4-c4ccc5cccnc5c4)c23)cc1
InChIInChI=1S/2C68H44N4/c1-2-19-49(20-3-1)71(50-37-39-51(40-38-50)72-63-30-12-10-23-54(63)55-24-11-13-31-64(55)72)65-32-14-29-60-66(56-25-6-4-21-52(56)47-35-33-45-17-15-41-69-61(45)43-47)58-27-8-9-28-59(58)67(68(60)65)57-26-7-5-22-53(57)48-36-34-46-18-16-42-70-62(46)44-48;1-2-18-49(19-3-1)71(50-34-36-51(37-35-50)72-65-28-12-10-22-55(65)56-23-11-13-29-66(56)72)52-38-39-61-62(44-52)68(58-25-7-5-21-54(58)48-33-31-46-17-15-41-70-64(46)43-48)60-27-9-8-26-59(60)67(61)57-24-6-4-20-53(57)47-32-30-45-16-14-40-69-63(45)42-47/h2*1-44H
InChIKeyVUIZZZXVZATMNI-UHFFFAOYSA-N
XLogP36.65
TPSA67.90 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms144
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001834.26
LogP ≤ 536.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine (CID 161402037) is N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine is c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccccc4-c4ccc5cccnc5c4)c4ccccc4c(-c4ccccc4-c4ccc5cccnc5c4)c3c2)cc1.c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3c(-c4ccccc4-c4ccc5cccnc5c4)c4ccccc4c(-c4ccccc4-c4ccc5cccnc5c4)c23)cc1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine?
The InChIKey is VUIZZZXVZATMNI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C68H44N4/c1-2-19-49(20-3-1)71(50-37-39-51(40-38-50)72-63-30-12-10-23-54(63)55-24-11-13-31-64(55)72)65-32-14-29-60-66(56-25-6-4-21-52(56)47-35-33-45-17-15-41-69-61(45)43-47)58-27-8-9-28-59(58)67(68(60)65)57-26-7-5-22-53(57)48-36-34-46-18-16-42-70-62(46)44-48;1-2-18-49(19-3-1)71(50-34-36-51(37-35-50)72-65-28-12-10-22-55(65)56-23-11-13-29-66(56)72)52-38-39-61-62(44-52)68(58-25-7-5-21-54(58)48-33-31-46-17-15-41-70-64(46)43-48)60-27-9-8-26-59(60)67(61)57-24-6-4-20-53(57)47-32-30-45-16-14-40-69-63(45)42-47/h2*1-44H.
What are the key properties of N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine?
N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine has a molecular weight of 1834.26 g/mol, XLogP of 36.65, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine is sourced from PubChem (CID 161402037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).