N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline

C36H24BrNO — CID 135165693

IUPACN-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline
SMILESBrc1ccc(N(c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C36H24BrNO/c37-27-19-23-29(24-20-27)38(34-15-6-4-11-30(34)25-9-2-1-3-10-25)28-21-17-26(18-22-28)31-13-8-14-33-32-12-5-7-16-35(32)39-36(31)33/h1-24H
InChIKeyMIKSJSVTZXRLIJ-UHFFFAOYSA-N
MW566.50 g/mol
LogP11.15
Rot. Bonds5

About N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline

N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline (PubChem CID 135165693) has the molecular formula C36H24BrNO and a molecular weight of 566.50 g/mol. Its IUPAC name is N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline.

Molecular Properties

Compound NameN-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline
PubChem CID135165693
Molecular FormulaC36H24BrNO
Molecular Weight566.50 g/mol
Exact Mass565.10
IUPAC NameN-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline
SMILESBrc1ccc(N(c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C36H24BrNO/c37-27-19-23-29(24-20-27)38(34-15-6-4-11-30(34)25-9-2-1-3-10-25)28-21-17-26(18-22-28)31-13-8-14-33-32-12-5-7-16-35(32)39-36(31)33/h1-24H
InChIKeyMIKSJSVTZXRLIJ-UHFFFAOYSA-N
XLogP11.15
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500566.50
LogP ≤ 511.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-dibenzofuran-4-ylphenyl)-N-(2-phenylphenyl)naphthalen-1-amine
CID 170676822
N-(4-dibenzofuran-4-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 122675345
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59136875
N-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-6-phenyldibenzofuran-4-amine
CID 167397842
2-(3-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)aniline
CID 126709649
N-[4-(2-phenylphenyl)phenyl]-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-4-amine
CID 164744348
N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 157079303
N-(4-dibenzofuran-4-ylphenyl)-3-phenyl-2-(2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 168788600
1-N,4-N-bis(4-dibenzofuran-4-ylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine
CID 59022075
4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-phenylaniline
CID 59022085
4-(4-bromophenyl)dibenzofuran
CID 59022098
N-(4-dibenzofuran-4-ylphenyl)-N-[2-[2-[2-(4-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-1-amine
CID 172500844

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline?
The IUPAC name of N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline (CID 135165693) is N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline.
What is the SMILES notation for N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline?
The canonical SMILES for N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline is Brc1ccc(N(c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccccc2-c2ccccc2)cc1.
What is the InChIKey of N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline?
The InChIKey is MIKSJSVTZXRLIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24BrNO/c37-27-19-23-29(24-20-27)38(34-15-6-4-11-30(34)25-9-2-1-3-10-25)28-21-17-26(18-22-28)31-13-8-14-33-32-12-5-7-16-35(32)39-36(31)33/h1-24H.
What are the key properties of N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline?
N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline has a molecular weight of 566.50 g/mol, XLogP of 11.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline is sourced from PubChem (CID 135165693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).