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

C13H7BrCl2FNO — CID 26897422

IUPAC5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1F)c1cc(Br)ccc1Cl
InChIInChI=1S/C13H7BrCl2FNO/c14-7-4-5-9(15)8(6-7)13(19)18-11-3-1-2-10(16)12(11)17/h1-6H,(H,18,19)
InChIKeyAQIASSDAECUBSA-UHFFFAOYSA-N
MW363.01 g/mol
LogP5.15
Rot. Bonds2

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

5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide (PubChem CID 26897422) has the molecular formula C13H7BrCl2FNO and a molecular weight of 363.01 g/mol. Its IUPAC name is 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide.

Molecular Properties

Compound Name5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide
PubChem CID26897422
Molecular FormulaC13H7BrCl2FNO
Molecular Weight363.01 g/mol
Exact Mass360.91
IUPAC Name5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1F)c1cc(Br)ccc1Cl
InChIInChI=1S/C13H7BrCl2FNO/c14-7-4-5-9(15)8(6-7)13(19)18-11-3-1-2-10(16)12(11)17/h1-6H,(H,18,19)
InChIKeyAQIASSDAECUBSA-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

5-bromo-N-(2-bromo-3-chlorophenyl)-2-chlorobenzamide
CID 103479655
5-bromo-N-(3-chloro-2-fluorophenyl)-2-(methylamino)pyridine-3-carboxamide
CID 62166293
5-bromo-N-(4-bromo-2,5-difluorophenyl)-2-chlorobenzamide
CID 103842628
N-(5-bromo-2-chlorophenyl)-2-fluoro-3-methylbenzamide
CID 80711881
N-(4-amino-2-chlorophenyl)-5-bromo-2-chlorobenzamide
CID 43378801
N-(5-amino-2-chlorophenyl)-5-bromo-2-chlorobenzamide
CID 43548736
5-bromo-2-chloro-N-[2-(chloromethyl)phenyl]benzamide
CID 114298302
5-bromo-N-(3-chloro-2-fluorophenyl)pyridine-3-carboxamide
CID 9145915
N-(5-bromo-2-methoxyphenyl)-3-chloro-2-fluorobenzamide
CID 80974125
N-(5-amino-2,4-difluorophenyl)-5-bromo-2-chlorobenzamide
CID 43549777
5-bromo-N-(2-carbamothioylphenyl)-2-chlorobenzamide
CID 43378988
4-bromo-N-(3-chloro-2-fluorophenyl)-1-methylpyrrole-2-carboxamide
CID 43411034

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide?
The IUPAC name of 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide (CID 26897422) is 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide.
What is the SMILES notation for 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide?
The canonical SMILES for 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide is O=C(Nc1cccc(Cl)c1F)c1cc(Br)ccc1Cl.
What is the InChIKey of 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide?
The InChIKey is AQIASSDAECUBSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7BrCl2FNO/c14-7-4-5-9(15)8(6-7)13(19)18-11-3-1-2-10(16)12(11)17/h1-6H,(H,18,19).
What are the key properties of 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide?
5-bromo-2-chloro-N-(3-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 5-bromo-2-chloro-N-(3-chloro-2-fluorophenyl)benzamide is sourced from PubChem (CID 26897422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).