4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide

C13H8Br2FNO2 — CID 113342873

IUPAC4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide
SMILESO=C(Nc1ccc(F)c(Br)c1)c1ccc(Br)c(O)c1
InChIInChI=1S/C13H8Br2FNO2/c14-9-3-1-7(5-12(9)18)13(19)17-8-2-4-11(16)10(15)6-8/h1-6,18H,(H,17,19)
InChIKeyVEPNKQHQNADHQR-UHFFFAOYSA-N
MW389.02 g/mol
LogP4.31
Rot. Bonds2

About 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide

4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide (PubChem CID 113342873) has the molecular formula C13H8Br2FNO2 and a molecular weight of 389.02 g/mol. Its IUPAC name is 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide.

Molecular Properties

Compound Name4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide
PubChem CID113342873
Molecular FormulaC13H8Br2FNO2
Molecular Weight389.02 g/mol
Exact Mass386.89
IUPAC Name4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide
SMILESO=C(Nc1ccc(F)c(Br)c1)c1ccc(Br)c(O)c1
InChIInChI=1S/C13H8Br2FNO2/c14-9-3-1-7(5-12(9)18)13(19)17-8-2-4-11(16)10(15)6-8/h1-6,18H,(H,17,19)
InChIKeyVEPNKQHQNADHQR-UHFFFAOYSA-N
XLogP4.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.02
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-(4-chloro-3-hydroxyphenyl)-4-fluorobenzamide
CID 107953628
4-bromo-N-(4-bromo-3-fluorophenyl)-3-fluorobenzamide
CID 65435198
N-(3-bromo-4-fluorophenyl)-3-fluoro-4-methylbenzamide
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3-bromo-N-(3-cyano-4-fluorophenyl)-4-fluorobenzamide
CID 103707295
N-(3-bromo-4-fluorophenyl)-4-methylsulfanylbenzamide
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3-bromo-4-fluoro-N-(3-fluorophenyl)benzamide
CID 103706269
N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide
CID 103871323
3-amino-4-bromo-N-(3,4-difluorophenyl)benzamide
CID 61090796
4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide
CID 103830447
4-bromo-3-chloro-N-(3-fluoro-4-hydroxyphenyl)benzamide
CID 81295822
3-bromo-N-(3-bromo-4-fluorophenyl)-4-methoxybenzamide
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N-(3-bromo-4-fluorophenyl)-3,5-dimethylbenzamide
CID 104779493

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide?
The IUPAC name of 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide (CID 113342873) is 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide.
What is the SMILES notation for 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide?
The canonical SMILES for 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide is O=C(Nc1ccc(F)c(Br)c1)c1ccc(Br)c(O)c1.
What is the InChIKey of 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide?
The InChIKey is VEPNKQHQNADHQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Br2FNO2/c14-9-3-1-7(5-12(9)18)13(19)17-8-2-4-11(16)10(15)6-8/h1-6,18H,(H,17,19).
What are the key properties of 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide?
4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide has a molecular weight of 389.02 g/mol, XLogP of 4.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide is sourced from PubChem (CID 113342873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).