4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide

C14H10Br2FNO — CID 107592498

IUPAC4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide
SMILESCc1cc(F)c(Br)cc1NC(=O)c1ccc(Br)cc1
InChIInChI=1S/C14H10Br2FNO/c1-8-6-12(17)11(16)7-13(8)18-14(19)9-2-4-10(15)5-3-9/h2-7H,1H3,(H,18,19)
InChIKeyJACLWKYIJOYDLT-UHFFFAOYSA-N
MW387.05 g/mol
LogP4.91
Rot. Bonds2

About 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide

4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide (PubChem CID 107592498) has the molecular formula C14H10Br2FNO and a molecular weight of 387.05 g/mol. Its IUPAC name is 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide
PubChem CID107592498
Molecular FormulaC14H10Br2FNO
Molecular Weight387.05 g/mol
Exact Mass384.91
IUPAC Name4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide
SMILESCc1cc(F)c(Br)cc1NC(=O)c1ccc(Br)cc1
InChIInChI=1S/C14H10Br2FNO/c1-8-6-12(17)11(16)7-13(8)18-14(19)9-2-4-10(15)5-3-9/h2-7H,1H3,(H,18,19)
InChIKeyJACLWKYIJOYDLT-UHFFFAOYSA-N
XLogP4.91
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.05
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-N-(5-bromo-2,4-difluorophenyl)benzamide
CID 102848004
3-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)-5-fluorobenzamide
CID 107592505
N-(5-bromo-4-fluoro-2-methylphenyl)-3-methoxy-4-methylbenzamide
CID 103274645
3-amino-5-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide
CID 107590868
N-(5-bromo-4-fluoro-2-methylphenyl)-1,3-benzodioxole-5-carboxamide
CID 103274651
N-(4-bromo-5-fluoro-2-methylphenyl)-3,5-dihydroxybenzamide
CID 104889817
4-bromo-N-(5-bromo-2-fluorophenyl)benzamide
CID 43555883
2-amino-N-(5-bromo-4-fluoro-2-methylphenyl)-6-methylpyridine-4-carboxamide
CID 107593919
4-amino-N-(4-bromo-5-fluoro-2-methylphenyl)-3-hydroxybenzamide
CID 102739332
4-bromo-N-(4-iodo-2-methylphenyl)benzamide
CID 1379401
N-(5-bromo-4-fluoro-2-methylphenyl)-2-fluoro-5-sulfanylbenzamide
CID 107590334
N-(5-bromo-4-fluoro-2-methylphenyl)furan-2-carboxamide
CID 103274678

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide?
The IUPAC name of 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide (CID 107592498) is 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide.
What is the SMILES notation for 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide?
The canonical SMILES for 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide is Cc1cc(F)c(Br)cc1NC(=O)c1ccc(Br)cc1.
What is the InChIKey of 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide?
The InChIKey is JACLWKYIJOYDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2FNO/c1-8-6-12(17)11(16)7-13(8)18-14(19)9-2-4-10(15)5-3-9/h2-7H,1H3,(H,18,19).
What are the key properties of 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide?
4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide has a molecular weight of 387.05 g/mol, XLogP of 4.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide is sourced from PubChem (CID 107592498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).