2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide

C13H7Br2Cl2NO — CID 113257224

IUPAC2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide
SMILESO=C(Nc1ccc(Br)cc1Cl)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H7Br2Cl2NO/c14-7-1-4-12(11(17)5-7)18-13(19)9-3-2-8(16)6-10(9)15/h1-6H,(H,18,19)
InChIKeyQLNMIWVJKOWDJI-UHFFFAOYSA-N
MW423.92 g/mol
LogP5.77
Rot. Bonds2

About 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide

2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide (PubChem CID 113257224) has the molecular formula C13H7Br2Cl2NO and a molecular weight of 423.92 g/mol. Its IUPAC name is 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide.

Molecular Properties

Compound Name2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide
PubChem CID113257224
Molecular FormulaC13H7Br2Cl2NO
Molecular Weight423.92 g/mol
Exact Mass420.83
IUPAC Name2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide
SMILESO=C(Nc1ccc(Br)cc1Cl)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H7Br2Cl2NO/c14-7-1-4-12(11(17)5-7)18-13(19)9-3-2-8(16)6-10(9)15/h1-6H,(H,18,19)
InChIKeyQLNMIWVJKOWDJI-UHFFFAOYSA-N
XLogP5.77
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.92
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-N-(4-bromo-2-fluorophenyl)-4-chlorobenzamide
CID 103763204
2-bromo-4-chloro-N-(2-chloro-4-iodophenyl)benzamide
CID 114024506
2-bromo-4-chloro-N-(2-chloro-4-hydroxyphenyl)benzamide
CID 107989011
2-bromo-4-chloro-N-(2-chlorophenyl)benzamide
CID 103763135
2,4-dibromo-N-(2-bromo-5-chlorophenyl)benzamide
CID 114018389
2-bromo-N-(2,4-dichlorophenyl)-4-fluorobenzamide
CID 27666994
4-bromo-N-(2-bromo-5-chlorophenyl)-2-chlorobenzamide
CID 81271772
4-bromo-N-(4-bromo-2-chlorophenyl)-2-hydroxybenzamide
CID 63524501
2-amino-4-bromo-N-(2-bromo-4-chlorophenyl)benzamide
CID 81263873
3-bromo-4-[(2-bromo-4-chlorobenzoyl)amino]benzoic acid
CID 107986722
N-(4-bromo-2-chlorophenyl)-2-chloro-4,5-difluorobenzamide
CID 3993061
4-amino-N-(4-bromo-2-chlorophenyl)-2-chlorobenzamide
CID 43347149

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide?
The IUPAC name of 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide (CID 113257224) is 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide.
What is the SMILES notation for 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide?
The canonical SMILES for 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide is O=C(Nc1ccc(Br)cc1Cl)c1ccc(Cl)cc1Br.
What is the InChIKey of 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide?
The InChIKey is QLNMIWVJKOWDJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Br2Cl2NO/c14-7-1-4-12(11(17)5-7)18-13(19)9-3-2-8(16)6-10(9)15/h1-6H,(H,18,19).
What are the key properties of 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide?
2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide has a molecular weight of 423.92 g/mol, XLogP of 5.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide is sourced from PubChem (CID 113257224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).