N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine

C164H106N6OS2 — CID 165065577

IUPACN-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine
SMILESc1ccc(-c2cccc3c2oc2c(N(c4ccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)cc4)c4cccc5ccccc45)cccc23)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4cccc(N(c5ccc(-c6cc7ccccc7c7ccccc67)cc5)c5ccc6sc7ccccc7c6c5)c4)c32)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4cccc(N(c5ccc(-c6cc7ccccc7c7ccccc67)cc5)c5cccc6sc7ccccc7c56)c4)c32)cc1
InChIInChI=1S/2C56H36N2S.C52H34N2O/c1-2-17-40(18-3-1)58-51-27-10-8-23-47(51)48-26-13-25-44(56(48)58)38-16-12-19-42(35-38)57(52-28-14-30-54-55(52)49-24-9-11-29-53(49)59-54)41-33-31-37(32-34-41)50-36-39-15-4-5-20-43(39)45-21-6-7-22-46(45)50;1-2-16-40(17-3-1)58-53-26-10-8-22-48(53)50-25-13-24-45(56(50)58)38-15-12-18-42(34-38)57(43-32-33-55-52(36-43)49-23-9-11-27-54(49)59-55)41-30-28-37(29-31-41)51-35-39-14-4-5-19-44(39)46-20-6-7-21-47(46)51;1-3-15-36(16-4-1)42-24-13-26-45-46-27-14-30-49(52(46)55-51(42)45)53(47-29-11-18-35-17-7-8-21-40(35)47)39-33-31-37(32-34-39)41-23-12-25-44-43-22-9-10-28-48(43)54(50(41)44)38-19-5-2-6-20-38/h2*1-36H;1-34H
InChIKeyRXAFISXNIOJQTA-UHFFFAOYSA-N
MW2240.83 g/mol
LogP47.16
Rot. Bonds18

About N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine

N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine (PubChem CID 165065577) has the molecular formula C164H106N6OS2 and a molecular weight of 2240.83 g/mol. Its IUPAC name is N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine
PubChem CID165065577
Molecular FormulaC164H106N6OS2
Molecular Weight2240.83 g/mol
Exact Mass2238.79
IUPAC NameN-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine
SMILESc1ccc(-c2cccc3c2oc2c(N(c4ccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)cc4)c4cccc5ccccc45)cccc23)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4cccc(N(c5ccc(-c6cc7ccccc7c7ccccc67)cc5)c5ccc6sc7ccccc7c6c5)c4)c32)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4cccc(N(c5ccc(-c6cc7ccccc7c7ccccc67)cc5)c5cccc6sc7ccccc7c56)c4)c32)cc1
InChIInChI=1S/2C56H36N2S.C52H34N2O/c1-2-17-40(18-3-1)58-51-27-10-8-23-47(51)48-26-13-25-44(56(48)58)38-16-12-19-42(35-38)57(52-28-14-30-54-55(52)49-24-9-11-29-53(49)59-54)41-33-31-37(32-34-41)50-36-39-15-4-5-20-43(39)45-21-6-7-22-46(45)50;1-2-16-40(17-3-1)58-53-26-10-8-22-48(53)50-25-13-24-45(56(50)58)38-15-12-18-42(34-38)57(43-32-33-55-52(36-43)49-23-9-11-27-54(49)59-55)41-30-28-37(29-31-41)51-35-39-14-4-5-19-44(39)46-20-6-7-21-47(46)51;1-3-15-36(16-4-1)42-24-13-26-45-46-27-14-30-49(52(46)55-51(42)45)53(47-29-11-18-35-17-7-8-21-40(35)47)39-33-31-37(32-34-39)41-23-12-25-44-43-22-9-10-28-48(43)54(50(41)44)38-19-5-2-6-20-38/h2*1-36H;1-34H
InChIKeyRXAFISXNIOJQTA-UHFFFAOYSA-N
XLogP47.16
TPSA37.65 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms173
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002240.83
LogP ≤ 547.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine with MolForge

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Related Compounds

N-[3-(9-phenylcarbazol-1-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-1-amine;N-[3-(9-phenylcarbazol-1-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-2-amine;N-[3-(9-phenylcarbazol-1-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-3-amine
CID 164995259
N-phenanthren-9-yl-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine
CID 164790553
N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-1-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-2-amine;N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-3-amine
CID 165000250
N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine
CID 164790578
N-[3-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzothiophen-1-amine;N-[3-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzothiophen-2-amine;N-[3-(9-phenylcarbazol-1-yl)phenyl]-N-(3-phenylphenyl)dibenzothiophen-3-amine
CID 164980163
N-dibenzofuran-4-yl-6-phenyl-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-1-yl-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-[3-(9-phenylcarbazol-1-yl)phenyl]-N-(6-phenyldibenzothiophen-4-yl)dibenzofuran-4-amine
CID 164991231
N-dibenzofuran-1-yl-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;bis(N-dibenzofuran-4-yl-6-phenyl-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine);N-dibenzothiophen-4-yl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-4-amine
CID 165040530
bis(3-carbazol-9-yl-N-(4-phenanthren-9-ylphenyl)-N-[4-(9-phenylcarbazol-1-yl)phenyl]aniline);N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 165016258
N-[4-(4-dibenzothiophen-1-ylphenyl)phenyl]-N-(4-phenanthren-9-ylphenyl)-6-phenyldibenzofuran-4-amine
CID 167396879
N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
CID 172502544
N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]dibenzothiophen-2-amine
CID 164790607
N-(3-dibenzothiophen-1-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)aniline
CID 170298651

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine?
The IUPAC name of N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine (CID 165065577) is N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine.
What is the SMILES notation for N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine?
The canonical SMILES for N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine is c1ccc(-c2cccc3c2oc2c(N(c4ccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)cc4)c4cccc5ccccc45)cccc23)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4cccc(N(c5ccc(-c6cc7ccccc7c7ccccc67)cc5)c5ccc6sc7ccccc7c6c5)c4)c32)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4cccc(N(c5ccc(-c6cc7ccccc7c7ccccc67)cc5)c5cccc6sc7ccccc7c56)c4)c32)cc1.
What is the InChIKey of N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine?
The InChIKey is RXAFISXNIOJQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H36N2S.C52H34N2O/c1-2-17-40(18-3-1)58-51-27-10-8-23-47(51)48-26-13-25-44(56(48)58)38-16-12-19-42(35-38)57(52-28-14-30-54-55(52)49-24-9-11-29-53(49)59-54)41-33-31-37(32-34-41)50-36-39-15-4-5-20-43(39)45-21-6-7-22-46(45)50;1-2-16-40(17-3-1)58-53-26-10-8-22-48(53)50-25-13-24-45(56(50)58)38-15-12-18-42(34-38)57(43-32-33-55-52(36-43)49-23-9-11-27-54(49)59-55)41-30-28-37(29-31-41)51-35-39-14-4-5-19-44(39)46-20-6-7-21-47(46)51;1-3-15-36(16-4-1)42-24-13-26-45-46-27-14-30-49(52(46)55-51(42)45)53(47-29-11-18-35-17-7-8-21-40(35)47)39-33-31-37(32-34-39)41-23-12-25-44-43-22-9-10-28-48(43)54(50(41)44)38-19-5-2-6-20-38/h2*1-36H;1-34H.
What are the key properties of N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine?
N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine has a molecular weight of 2240.83 g/mol, XLogP of 47.16, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-1-amine;N-(4-phenanthren-9-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]dibenzothiophen-2-amine is sourced from PubChem (CID 165065577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).