4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide

C13H7BrCl2FNO — CID 81308166

IUPAC4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide
SMILESO=C(Nc1cc(Cl)ccc1F)c1ccc(Br)c(Cl)c1
InChIInChI=1S/C13H7BrCl2FNO/c14-9-3-1-7(5-10(9)16)13(19)18-12-6-8(15)2-4-11(12)17/h1-6H,(H,18,19)
InChIKeyOBGKGLAMJYGMHZ-UHFFFAOYSA-N
MW363.01 g/mol
LogP5.15
Rot. Bonds2

About 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide

4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide (PubChem CID 81308166) has the molecular formula C13H7BrCl2FNO and a molecular weight of 363.01 g/mol. Its IUPAC name is 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide.

Molecular Properties

Compound Name4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide
PubChem CID81308166
Molecular FormulaC13H7BrCl2FNO
Molecular Weight363.01 g/mol
Exact Mass360.91
IUPAC Name4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide
SMILESO=C(Nc1cc(Cl)ccc1F)c1ccc(Br)c(Cl)c1
InChIInChI=1S/C13H7BrCl2FNO/c14-9-3-1-7(5-10(9)16)13(19)18-12-6-8(15)2-4-11(12)17/h1-6H,(H,18,19)
InChIKeyOBGKGLAMJYGMHZ-UHFFFAOYSA-N
XLogP5.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.01
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-amino-4-chlorophenyl)-4-bromo-3-chlorobenzamide
CID 81290030
N-(2-bromo-5-fluorophenyl)-3-chloro-4-fluorobenzamide
CID 113264517
N-(5-chloro-2-fluorophenyl)-4-fluorobenzamide
CID 2664585
4-bromo-N-(4-chloro-2-iodophenyl)-3-fluorobenzamide
CID 107626139
4-bromo-3-chloro-N-(3-fluoro-4-hydroxyphenyl)benzamide
CID 81295822
N-(2-bromo-4-chlorophenyl)-3-chloro-4-hydroxybenzamide
CID 81271353
N-(2-bromo-5-chlorophenyl)-4-(trifluoromethyl)benzamide
CID 81261644
N-(2-amino-4,6-difluorophenyl)-4-bromo-3-chlorobenzamide
CID 81313689
4-amino-N-(2-bromo-5-chlorophenyl)-3-methylbenzamide
CID 81262936
4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide
CID 113352699
3-bromo-4-fluoro-N-(2,4,5-trifluorophenyl)benzamide
CID 103707329
4-bromo-N-(2,5-dichlorophenyl)benzamide
CID 763593

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide?
The IUPAC name of 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide (CID 81308166) is 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide.
What is the SMILES notation for 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide?
The canonical SMILES for 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide is O=C(Nc1cc(Cl)ccc1F)c1ccc(Br)c(Cl)c1.
What is the InChIKey of 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide?
The InChIKey is OBGKGLAMJYGMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7BrCl2FNO/c14-9-3-1-7(5-10(9)16)13(19)18-12-6-8(15)2-4-11(12)17/h1-6H,(H,18,19).
What are the key properties of 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide?
4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide has a molecular weight of 363.01 g/mol, XLogP of 5.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide is sourced from PubChem (CID 81308166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).