9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine

C54H35N3O — CID 170286483

IUPAC9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine
SMILESc1ccc(-c2cccc3c2oc2c(N(c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c4cccc5c4c4ccccc4n5-c4ccccc4)cccc23)cc1
InChIInChI=1S/C54H35N3O/c1-4-17-36(18-5-1)40-25-14-26-43-44-27-15-32-50(54(44)58-53(40)43)57(39-33-34-42-41-23-10-12-28-46(41)56(51(42)35-39)38-21-8-3-9-22-38)49-31-16-30-48-52(49)45-24-11-13-29-47(45)55(48)37-19-6-2-7-20-37/h1-35H
InChIKeyUIHYXZKMBZQWOY-UHFFFAOYSA-N
MW741.89 g/mol
LogP14.92
Rot. Bonds6

About 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine

9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine (PubChem CID 170286483) has the molecular formula C54H35N3O and a molecular weight of 741.89 g/mol. Its IUPAC name is 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine.

Molecular Properties

Compound Name9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine
PubChem CID170286483
Molecular FormulaC54H35N3O
Molecular Weight741.89 g/mol
Exact Mass741.28
IUPAC Name9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine
SMILESc1ccc(-c2cccc3c2oc2c(N(c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c4cccc5c4c4ccccc4n5-c4ccccc4)cccc23)cc1
InChIInChI=1S/C54H35N3O/c1-4-17-36(18-5-1)40-25-14-26-43-44-27-15-32-50(54(44)58-53(40)43)57(39-33-34-42-41-23-10-12-28-46(41)56(51(42)35-39)38-21-8-3-9-22-38)49-31-16-30-48-52(49)45-24-11-13-29-47(45)55(48)37-19-6-2-7-20-37/h1-35H
InChIKeyUIHYXZKMBZQWOY-UHFFFAOYSA-N
XLogP14.92
TPSA26.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500741.89
LogP ≤ 514.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-diphenylphenyl)-9-phenyl-N-(9-phenylcarbazol-4-yl)carbazol-2-amine
CID 170286478
N-dibenzofuran-4-yl-6,8,9-triphenyl-N-(9-phenylcarbazol-2-yl)carbazol-4-amine
CID 177286504
9-phenyl-N-(3-phenylphenyl)-N-[10-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-yl]carbazol-2-amine
CID 167143325
9-phenyl-N-(9-phenylcarbazol-4-yl)-N-[9-(3-phenylphenyl)carbazol-2-yl]carbazol-2-amine
CID 170286782
N-(4-carbazol-9-ylphenyl)-N,10-diphenylnaphtho[1,2-b][1]benzofuran-5-amine
CID 167143326
N-dibenzofuran-1-yl-5,9-diphenyl-N-(2-phenylphenyl)carbazol-2-amine
CID 169009626
N-naphtho[1,2-b][1]benzofuran-10-yl-9-phenyl-N-(4-phenylnaphthalen-1-yl)carbazol-3-amine
CID 166997166
N-(2-carbazol-9-ylphenyl)-5,9-diphenyl-N-(2-phenylphenyl)carbazol-2-amine
CID 169009864
N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-N-(4-phenanthren-9-ylphenyl)-9-phenylcarbazol-4-amine
CID 177121504
N-naphthalen-1-yl-6-phenyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]dibenzofuran-4-amine
CID 164790578
4-(3-carbazol-9-ylphenyl)-N-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)dibenzofuran-1-amine
CID 176609625
N-(4-dibenzofuran-3-ylphenyl)-9-phenyl-N-[4-(6-phenyldibenzofuran-2-yl)phenyl]carbazol-4-amine
CID 168805442

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine?
The IUPAC name of 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine (CID 170286483) is 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine.
What is the SMILES notation for 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine?
The canonical SMILES for 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine is c1ccc(-c2cccc3c2oc2c(N(c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c4cccc5c4c4ccccc4n5-c4ccccc4)cccc23)cc1.
What is the InChIKey of 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine?
The InChIKey is UIHYXZKMBZQWOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H35N3O/c1-4-17-36(18-5-1)40-25-14-26-43-44-27-15-32-50(54(44)58-53(40)43)57(39-33-34-42-41-23-10-12-28-46(41)56(51(42)35-39)38-21-8-3-9-22-38)49-31-16-30-48-52(49)45-24-11-13-29-47(45)55(48)37-19-6-2-7-20-37/h1-35H.
What are the key properties of 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine?
9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine has a molecular weight of 741.89 g/mol, XLogP of 14.92, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-N-(9-phenylcarbazol-4-yl)-N-(6-phenyldibenzofuran-4-yl)carbazol-2-amine is sourced from PubChem (CID 170286483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).