5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide

C13H8BrClFNO2 — CID 64786910

IUPAC5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide
SMILESO=C(Nc1ccc(Cl)c(O)c1)c1cc(Br)ccc1F
InChIInChI=1S/C13H8BrClFNO2/c14-7-1-4-11(16)9(5-7)13(19)17-8-2-3-10(15)12(18)6-8/h1-6,18H,(H,17,19)
InChIKeyBUNLYTINVPQVKK-UHFFFAOYSA-N
MW344.57 g/mol
LogP4.20
Rot. Bonds2

About 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide

5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide (PubChem CID 64786910) has the molecular formula C13H8BrClFNO2 and a molecular weight of 344.57 g/mol. Its IUPAC name is 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide.

Molecular Properties

Compound Name5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide
PubChem CID64786910
Molecular FormulaC13H8BrClFNO2
Molecular Weight344.57 g/mol
Exact Mass342.94
IUPAC Name5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide
SMILESO=C(Nc1ccc(Cl)c(O)c1)c1cc(Br)ccc1F
InChIInChI=1S/C13H8BrClFNO2/c14-7-1-4-11(16)9(5-7)13(19)17-8-2-3-10(15)12(18)6-8/h1-6,18H,(H,17,19)
InChIKeyBUNLYTINVPQVKK-UHFFFAOYSA-N
XLogP4.20
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.57
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-2-fluoro-N-(3-hydroxy-4-methylphenyl)benzamide
CID 64793080
4-chloro-N-(4-chloro-3-hydroxyphenyl)-2,5-difluorobenzamide
CID 82772330
5-bromo-2-fluoro-N-(4-hydroxyphenyl)benzamide
CID 28739625
2,5-dichloro-N-(4-chloro-3-hydroxyphenyl)benzamide
CID 64789245
5-bromo-N-(4-bromo-3-fluorophenyl)-2-fluorobenzamide
CID 65438137
3-bromo-N-(4-chloro-3-hydroxyphenyl)-4-fluorobenzamide
CID 107953628
2-bromo-N-(4-chloro-3-hydroxyphenyl)-5-fluorobenzamide
CID 64789249
5-bromo-N-(6-chloro-3-pyridinyl)-2-fluorobenzamide
CID 78929857
5-bromo-2-fluoro-N-(2,4,5-trichlorophenyl)benzamide
CID 28547728
N-(4-bromo-3-chlorophenyl)-5-chloro-2-fluorobenzamide
CID 107619744
5-[(5-bromo-2-fluorobenzoyl)amino]-2-methylbenzoic acid
CID 63653499
N-(3-amino-4-chlorophenyl)-5-bromo-2-hydroxybenzamide
CID 107729182

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide?
The IUPAC name of 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide (CID 64786910) is 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide.
What is the SMILES notation for 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide?
The canonical SMILES for 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide is O=C(Nc1ccc(Cl)c(O)c1)c1cc(Br)ccc1F.
What is the InChIKey of 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide?
The InChIKey is BUNLYTINVPQVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrClFNO2/c14-7-1-4-11(16)9(5-7)13(19)17-8-2-3-10(15)12(18)6-8/h1-6,18H,(H,17,19).
What are the key properties of 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide?
5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide has a molecular weight of 344.57 g/mol, XLogP of 4.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-chloro-3-hydroxyphenyl)-2-fluorobenzamide is sourced from PubChem (CID 64786910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).