2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide

C13H7Br2ClFNO — CID 103765558

IUPAC2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
SMILESO=C(Nc1c(F)cccc1Br)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H7Br2ClFNO/c14-9-2-1-3-11(17)12(9)18-13(19)8-5-4-7(16)6-10(8)15/h1-6H,(H,18,19)
InChIKeyARBQTRBZDHFBAS-UHFFFAOYSA-N
MW407.46 g/mol
LogP5.26
Rot. Bonds2

About 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide

2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide (PubChem CID 103765558) has the molecular formula C13H7Br2ClFNO and a molecular weight of 407.46 g/mol. Its IUPAC name is 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide.

Molecular Properties

Compound Name2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
PubChem CID103765558
Molecular FormulaC13H7Br2ClFNO
Molecular Weight407.46 g/mol
Exact Mass404.86
IUPAC Name2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
SMILESO=C(Nc1c(F)cccc1Br)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H7Br2ClFNO/c14-9-2-1-3-11(17)12(9)18-13(19)8-5-4-7(16)6-10(8)15/h1-6H,(H,18,19)
InChIKeyARBQTRBZDHFBAS-UHFFFAOYSA-N
XLogP5.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.46
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-4-chloro-N-(2,6-difluorophenyl)benzamide
CID 113257211
N-(2-amino-6-fluorophenyl)-2-bromo-4-chlorobenzamide
CID 107986345
N-(2-bromo-6-fluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 107676888
N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide
CID 103741269
N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide
CID 107603353
N-(2-amino-6-chlorophenyl)-2-bromo-4-chlorobenzamide
CID 107986320
2-amino-N-(2-bromo-6-fluorophenyl)-5-fluorobenzamide
CID 107596162
3-bromo-2-[(2,4-dichlorobenzoyl)amino]benzoic acid
CID 63112414
3-amino-2-bromo-N-(2-bromo-6-fluorophenyl)benzamide
CID 107596264
2-bromo-N-(4-bromo-2-fluorophenyl)-4-chlorobenzamide
CID 103763204
N-(2-bromo-6-fluorophenyl)-3-chloro-4-hydroxybenzamide
CID 107600810
3-amino-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
CID 107596191

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide?
The IUPAC name of 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide (CID 103765558) is 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide.
What is the SMILES notation for 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide?
The canonical SMILES for 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide is O=C(Nc1c(F)cccc1Br)c1ccc(Cl)cc1Br.
What is the InChIKey of 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide?
The InChIKey is ARBQTRBZDHFBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Br2ClFNO/c14-9-2-1-3-11(17)12(9)18-13(19)8-5-4-7(16)6-10(8)15/h1-6H,(H,18,19).
What are the key properties of 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide?
2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide has a molecular weight of 407.46 g/mol, XLogP of 5.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide is sourced from PubChem (CID 103765558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).