2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine

C60H42N4 — CID 154965850

IUPAC2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4c(N(c5ccccc5)c5ccccc5)cc(N(c5ccccc5)c5cccc6c5c5ccccc5n6-c5ccccc5)cc43)cc2)cc1
InChIInChI=1S/C60H42N4/c1-6-21-43(22-7-1)44-37-39-49(40-38-44)64-54-34-19-17-32-52(54)60-57(61(45-23-8-2-9-24-45)46-25-10-3-11-26-46)41-50(42-58(60)64)62(47-27-12-4-13-28-47)55-35-20-36-56-59(55)51-31-16-18-33-53(51)63(56)48-29-14-5-15-30-48/h1-42H
InChIKeyAJOSZHUCURGLSB-UHFFFAOYSA-N
MW819.02 g/mol
LogP16.49
Rot. Bonds9

About 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine

2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine (PubChem CID 154965850) has the molecular formula C60H42N4 and a molecular weight of 819.02 g/mol. Its IUPAC name is 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine
PubChem CID154965850
Molecular FormulaC60H42N4
Molecular Weight819.02 g/mol
Exact Mass818.34
IUPAC Name2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4c(N(c5ccccc5)c5ccccc5)cc(N(c5ccccc5)c5cccc6c5c5ccccc5n6-c5ccccc5)cc43)cc2)cc1
InChIInChI=1S/C60H42N4/c1-6-21-43(22-7-1)44-37-39-49(40-38-44)64-54-34-19-17-32-52(54)60-57(61(45-23-8-2-9-24-45)46-25-10-3-11-26-46)41-50(42-58(60)64)62(47-27-12-4-13-28-47)55-35-20-36-56-59(55)51-31-16-18-33-53(51)63(56)48-29-14-5-15-30-48/h1-42H
InChIKeyAJOSZHUCURGLSB-UHFFFAOYSA-N
XLogP16.49
TPSA16.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500819.02
LogP ≤ 516.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine with MolForge

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Related Compounds

9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine
CID 90377540
N,9-diphenyl-N-[6-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]carbazol-4-amine
CID 174257716
N,N,9-tris(4-phenylphenyl)carbazol-2-amine;N,N,9-tris(4-phenylphenyl)carbazol-3-amine;N,N,9-tris(4-phenylphenyl)carbazol-4-amine
CID 159285167
9-phenyl-N-(4-phenylphenyl)-N-[4-[3-phenyl-5-(9-phenylcarbazol-4-yl)phenyl]phenyl]carbazol-4-amine
CID 176878123
N-phenyl-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazol-1-amine
CID 155004275
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine
CID 174258250
2-N,4-N-di(dibenzofuran-1-yl)-2-N,4-N,9-triphenylcarbazole-2,4-diamine
CID 139496690
N,9-diphenyl-N-[10-(4-phenylphenyl)phenanthren-9-yl]carbazol-4-amine
CID 155305653
[4-(4-phenyl-N-(9-phenylcarbazol-4-yl)anilino)phenyl]boronic acid
CID 171410503
9-phenyl-N-(9-phenylcarbazol-4-yl)-N-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-2-amine
CID 170286782
N,N,9-triphenyl-6-(9-phenylcarbazol-3-yl)carbazol-4-amine
CID 134369862
9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine
CID 90377538

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine?
The IUPAC name of 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine (CID 154965850) is 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine.
What is the SMILES notation for 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine?
The canonical SMILES for 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine is c1ccc(-c2ccc(-n3c4ccccc4c4c(N(c5ccccc5)c5ccccc5)cc(N(c5ccccc5)c5cccc6c5c5ccccc5n6-c5ccccc5)cc43)cc2)cc1.
What is the InChIKey of 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine?
The InChIKey is AJOSZHUCURGLSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H42N4/c1-6-21-43(22-7-1)44-37-39-49(40-38-44)64-54-34-19-17-32-52(54)60-57(61(45-23-8-2-9-24-45)46-25-10-3-11-26-46)41-50(42-58(60)64)62(47-27-12-4-13-28-47)55-35-20-36-56-59(55)51-31-16-18-33-53(51)63(56)48-29-14-5-15-30-48/h1-42H.
What are the key properties of 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine?
2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine has a molecular weight of 819.02 g/mol, XLogP of 16.49, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine is sourced from PubChem (CID 154965850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).