N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide

C13H8BrClFNO2 — CID 28938603

IUPACN-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccc(O)c(Cl)c1
InChIInChI=1S/C13H8BrClFNO2/c14-9-6-8(16)2-3-11(9)17-13(19)7-1-4-12(18)10(15)5-7/h1-6,18H,(H,17,19)
InChIKeyWVKLXYBVDTTWBE-UHFFFAOYSA-N
MW344.57 g/mol
LogP4.20
Rot. Bonds2

About N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide

N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide (PubChem CID 28938603) has the molecular formula C13H8BrClFNO2 and a molecular weight of 344.57 g/mol. Its IUPAC name is N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide
PubChem CID28938603
Molecular FormulaC13H8BrClFNO2
Molecular Weight344.57 g/mol
Exact Mass342.94
IUPAC NameN-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccc(O)c(Cl)c1
InChIInChI=1S/C13H8BrClFNO2/c14-9-6-8(16)2-3-11(9)17-13(19)7-1-4-12(18)10(15)5-7/h1-6,18H,(H,17,19)
InChIKeyWVKLXYBVDTTWBE-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

Analyze N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bromo-4-chlorophenyl)-3-chloro-4-hydroxybenzamide
CID 81271353
N-(2-bromo-4-fluorophenyl)-4-fluorobenzamide
CID 28938573
3-chloro-N-(2-cyano-4-fluorophenyl)-4-hydroxybenzamide
CID 82015912
N-(2-bromo-4-fluorophenyl)-3-chloro-4-nitrobenzamide
CID 82778464
N-(2-bromo-4-cyanophenyl)-3-chloro-4-hydroxybenzamide
CID 107791108
N-(2-bromo-4-fluorophenyl)-3,5-dichlorobenzamide
CID 28938547
4-bromo-N-(2-bromo-4-fluorophenyl)-3-fluorobenzamide
CID 47421840
N-(2-bromo-5-fluorophenyl)-3-chloro-4-fluorobenzamide
CID 113264517
4-amino-N-(2-bromo-4-fluorophenyl)-3-methylbenzamide
CID 28938520
N-(2-chloro-5-fluorophenyl)-3,4-dihydroxybenzamide
CID 103956903
N-(2-bromo-4-fluorophenyl)-3-methyl-4-(methylamino)benzamide
CID 63210074
N-(2-bromo-4-fluorophenyl)-4,5-dichloro-1H-pyrrole-2-carboxamide
CID 43134338

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide?
The IUPAC name of N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide (CID 28938603) is N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide.
What is the SMILES notation for N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide?
The canonical SMILES for N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide is O=C(Nc1ccc(F)cc1Br)c1ccc(O)c(Cl)c1.
What is the InChIKey of N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide?
The InChIKey is WVKLXYBVDTTWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrClFNO2/c14-9-6-8(16)2-3-11(9)17-13(19)7-1-4-12(18)10(15)5-7/h1-6,18H,(H,17,19).
What are the key properties of N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide?
N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide 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 N-(2-bromo-4-fluorophenyl)-3-chloro-4-hydroxybenzamide is sourced from PubChem (CID 28938603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).