2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline

C104H73BrN4 — CID 159016137

IUPAC2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline
SMILESBrc1ccc(-c2ccc3ccccc3c2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6ccccc6c5)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(Nc4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1
InChIInChI=1S/C52H36N2.C36H26N2.C16H11Br/c1-2-10-37(11-3-1)39-18-20-40(21-19-39)41-24-28-45(29-25-41)53(46-30-26-42(27-31-46)44-23-22-38-12-4-5-13-43(38)36-44)47-32-34-48(35-33-47)54-51-16-8-6-14-49(51)50-15-7-9-17-52(50)54;1-2-8-26(9-3-1)27-14-16-28(17-15-27)29-18-20-30(21-19-29)37-31-22-24-32(25-23-31)38-35-12-6-4-10-33(35)34-11-5-7-13-36(34)38;17-16-9-7-13(8-10-16)15-6-5-12-3-1-2-4-14(12)11-15/h1-36H;1-25,37H;1-11H
InChIKeyJTCOUMMAOYLWGS-UHFFFAOYSA-N
MW1458.66 g/mol
LogP29.54
Rot. Bonds13

About 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline

2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline (PubChem CID 159016137) has the molecular formula C104H73BrN4 and a molecular weight of 1458.66 g/mol. Its IUPAC name is 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline.

Molecular Properties

Compound Name2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline
PubChem CID159016137
Molecular FormulaC104H73BrN4
Molecular Weight1458.66 g/mol
Exact Mass1456.50
IUPAC Name2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline
SMILESBrc1ccc(-c2ccc3ccccc3c2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6ccccc6c5)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(Nc4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1
InChIInChI=1S/C52H36N2.C36H26N2.C16H11Br/c1-2-10-37(11-3-1)39-18-20-40(21-19-39)41-24-28-45(29-25-41)53(46-30-26-42(27-31-46)44-23-22-38-12-4-5-13-43(38)36-44)47-32-34-48(35-33-47)54-51-16-8-6-14-49(51)50-15-7-9-17-52(50)54;1-2-8-26(9-3-1)27-14-16-28(17-15-27)29-18-20-30(21-19-29)37-31-22-24-32(25-23-31)38-35-12-6-4-10-33(35)34-11-5-7-13-36(34)38;17-16-9-7-13(8-10-16)15-6-5-12-3-1-2-4-14(12)11-15/h1-36H;1-25,37H;1-11H
InChIKeyJTCOUMMAOYLWGS-UHFFFAOYSA-N
XLogP29.54
TPSA25.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms109
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001458.66
LogP ≤ 529.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline with MolForge

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Related Compounds

N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline
CID 146579381
2-(4-bromophenyl)naphthalene;4-(3-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;4-(3-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 159073557
N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline
CID 165047575
N-(4-carbazol-9-ylphenyl)-N-[4-(6-phenylnaphthalen-2-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 146580367
2-(4-bromophenyl)-9,10-diphenylanthracene;4-carbazol-9-yl-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-(9,10-diphenylanthracen-2-yl)-N-phenylaniline;methane
CID 159608625
2-(4-bromophenyl)-9-phenylcarbazole;9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 160525115
9-[4-(4-bromophenyl)phenyl]-10-phenylanthracene;N-phenyl-4-[4-(10-phenylanthracen-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 159237953
N-(4-naphthalen-2-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 166956515
N-(4-carbazol-9-ylphenyl)-3-naphthalen-2-yl-N-phenylaniline
CID 135164563
4-(3-carbazol-9-ylphenyl)-N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 146578444
N-[4-(6-carbazol-9-ylnaphthalen-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 142727938
N-(4-carbazol-9-ylphenyl)-4-[6-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-yl]-N-phenylaniline
CID 59501688

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline?
The IUPAC name of 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline (CID 159016137) is 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline.
What is the SMILES notation for 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline?
The canonical SMILES for 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline is Brc1ccc(-c2ccc3ccccc3c2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6ccccc6c5)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(Nc4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1.
What is the InChIKey of 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline?
The InChIKey is JTCOUMMAOYLWGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H36N2.C36H26N2.C16H11Br/c1-2-10-37(11-3-1)39-18-20-40(21-19-39)41-24-28-45(29-25-41)53(46-30-26-42(27-31-46)44-23-22-38-12-4-5-13-43(38)36-44)47-32-34-48(35-33-47)54-51-16-8-6-14-49(51)50-15-7-9-17-52(50)54;1-2-8-26(9-3-1)27-14-16-28(17-15-27)29-18-20-30(21-19-29)37-31-22-24-32(25-23-31)38-35-12-6-4-10-33(35)34-11-5-7-13-36(34)38;17-16-9-7-13(8-10-16)15-6-5-12-3-1-2-4-14(12)11-15/h1-36H;1-25,37H;1-11H.
What are the key properties of 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline?
2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline has a molecular weight of 1458.66 g/mol, XLogP of 29.54, 13 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)naphthalene;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-phenylphenyl)aniline is sourced from PubChem (CID 159016137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).