2-bromo-4-chloro-N-(2-chlorophenyl)benzamide

C13H8BrCl2NO — CID 103763135

IUPAC2-bromo-4-chloro-N-(2-chlorophenyl)benzamide
SMILESO=C(Nc1ccccc1Cl)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H8BrCl2NO/c14-10-7-8(15)5-6-9(10)13(18)17-12-4-2-1-3-11(12)16/h1-7H,(H,17,18)
InChIKeyLIOXXKYHYQFGGI-UHFFFAOYSA-N
MW345.02 g/mol
LogP5.01
Rot. Bonds2

About 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide

2-bromo-4-chloro-N-(2-chlorophenyl)benzamide (PubChem CID 103763135) has the molecular formula C13H8BrCl2NO and a molecular weight of 345.02 g/mol. Its IUPAC name is 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide.

Molecular Properties

Compound Name2-bromo-4-chloro-N-(2-chlorophenyl)benzamide
PubChem CID103763135
Molecular FormulaC13H8BrCl2NO
Molecular Weight345.02 g/mol
Exact Mass342.92
IUPAC Name2-bromo-4-chloro-N-(2-chlorophenyl)benzamide
SMILESO=C(Nc1ccccc1Cl)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H8BrCl2NO/c14-10-7-8(15)5-6-9(10)13(18)17-12-4-2-1-3-11(12)16/h1-7H,(H,17,18)
InChIKeyLIOXXKYHYQFGGI-UHFFFAOYSA-N
XLogP5.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.02
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide
CID 113257224
2-bromo-4-chloro-N-(2-chloro-4-iodophenyl)benzamide
CID 114024506
2-bromo-4-chloro-N-(2-chloro-4-hydroxyphenyl)benzamide
CID 107989011
methyl 2-[(2-bromo-4-chlorobenzoyl)amino]benzoate
CID 103763170
2-bromo-N-(2,4-dichlorophenyl)-4-fluorobenzamide
CID 27666994
2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide
CID 86813420
N-(2-amino-6-chlorophenyl)-2-bromo-4-chlorobenzamide
CID 107986320
2-[(2-bromo-4-chlorobenzoyl)amino]-6-methylbenzoic acid
CID 107986716
2-bromo-N-(4-bromo-2-fluorophenyl)-4-chlorobenzamide
CID 103763204
N-(2-bromo-4-chlorophenyl)-2,3-dichlorobenzamide
CID 81028936
5-bromo-N-(2-chlorophenyl)-2-methylbenzamide
CID 65306919
2,4-dibromo-N-(2-bromo-5-chlorophenyl)benzamide
CID 114018389

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide?
The IUPAC name of 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide (CID 103763135) is 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide.
What is the SMILES notation for 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide?
The canonical SMILES for 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide is O=C(Nc1ccccc1Cl)c1ccc(Cl)cc1Br.
What is the InChIKey of 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide?
The InChIKey is LIOXXKYHYQFGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrCl2NO/c14-10-7-8(15)5-6-9(10)13(18)17-12-4-2-1-3-11(12)16/h1-7H,(H,17,18).
What are the key properties of 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide?
2-bromo-4-chloro-N-(2-chlorophenyl)benzamide has a molecular weight of 345.02 g/mol, XLogP of 5.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-chloro-N-(2-chlorophenyl)benzamide is sourced from PubChem (CID 103763135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).