4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline

C24H17Br2N — CID 141276570

IUPAC4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline
SMILESBrc1ccc(Nc2ccc(Br)cc2-c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C24H17Br2N/c25-18-10-13-20(14-11-18)27-24-15-12-19(26)16-23(24)22-9-5-4-8-21(22)17-6-2-1-3-7-17/h1-16,27H
InChIKeyYEQPPSKUZMQSJJ-UHFFFAOYSA-N
MW479.22 g/mol
LogP8.29
Rot. Bonds4

About 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline

4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline (PubChem CID 141276570) has the molecular formula C24H17Br2N and a molecular weight of 479.22 g/mol. Its IUPAC name is 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline.

Molecular Properties

Compound Name4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline
PubChem CID141276570
Molecular FormulaC24H17Br2N
Molecular Weight479.22 g/mol
Exact Mass476.97
IUPAC Name4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline
SMILESBrc1ccc(Nc2ccc(Br)cc2-c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C24H17Br2N/c25-18-10-13-20(14-11-18)27-24-15-12-19(26)16-23(24)22-9-5-4-8-21(22)17-6-2-1-3-7-17/h1-16,27H
InChIKeyYEQPPSKUZMQSJJ-UHFFFAOYSA-N
XLogP8.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500479.22
LogP ≤ 58.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,4-N-bis(4-bromophenyl)-2-phenylbenzene-1,4-diamine
CID 141276562
2-(4-phenylphenyl)-N-[4-[4-[2-(4-phenylphenyl)anilino]phenyl]phenyl]aniline
CID 69449342
benzene;N,2-diphenylaniline
CID 175029921
N,2-diphenyl-4-[3-phenyl-4-[4-(4-phenylphenyl)anilino]phenyl]aniline
CID 121262444
2-phenyl-N-[4-[4-(4-phenylanilino)phenyl]phenyl]aniline
CID 118616888
1-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine
CID 118429255
2-(4-bromophenyl)-N-[4-(trifluoromethyl)phenyl]aniline
CID 169108707
3-bromo-N-(3-bromophenyl)-2-(2-phenylphenyl)aniline
CID 141276571
N-(4-bromophenyl)-2-phenylquinolin-4-amine;hydrochloride
CID 139593880
4-[4-(3,5-diphenylanilino)-3-phenylphenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 118907736
4-bromo-2-(2-phenylphenyl)benzaldehyde
CID 175223605
5-bromo-N-(2-phenylphenyl)pyridin-3-amine
CID 104531475

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline?
The IUPAC name of 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline (CID 141276570) is 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline.
What is the SMILES notation for 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline?
The canonical SMILES for 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline is Brc1ccc(Nc2ccc(Br)cc2-c2ccccc2-c2ccccc2)cc1.
What is the InChIKey of 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline?
The InChIKey is YEQPPSKUZMQSJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17Br2N/c25-18-10-13-20(14-11-18)27-24-15-12-19(26)16-23(24)22-9-5-4-8-21(22)17-6-2-1-3-7-17/h1-16,27H.
What are the key properties of 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline?
4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline has a molecular weight of 479.22 g/mol, XLogP of 8.29, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(4-bromophenyl)-2-(2-phenylphenyl)aniline is sourced from PubChem (CID 141276570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).