4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide

C13H8BrClFNO — CID 4565122

IUPAC4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc(Br)cc1F
InChIInChI=1S/C13H8BrClFNO/c14-8-1-6-11(12(16)7-8)13(18)17-10-4-2-9(15)3-5-10/h1-7H,(H,17,18)
InChIKeyFSBRTBVTIRFXOF-UHFFFAOYSA-N
MW328.57 g/mol
LogP4.49
Rot. Bonds2

About 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide

4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide (PubChem CID 4565122) has the molecular formula C13H8BrClFNO and a molecular weight of 328.57 g/mol. Its IUPAC name is 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide.

Molecular Properties

Compound Name4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide
PubChem CID4565122
Molecular FormulaC13H8BrClFNO
Molecular Weight328.57 g/mol
Exact Mass326.95
IUPAC Name4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc(Br)cc1F
InChIInChI=1S/C13H8BrClFNO/c14-8-1-6-11(12(16)7-8)13(18)17-10-4-2-9(15)3-5-10/h1-7H,(H,17,18)
InChIKeyFSBRTBVTIRFXOF-UHFFFAOYSA-N
XLogP4.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.57
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide 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

Benzamide, N-(3-bromophenyl)-
CID 202396
Benzamide, N-(4-chlorophenyl)-
CID 96646
N-(3-Chlorophenyl)benzamide
CID 95833
N-(2-Chlorophenyl)benzamide
CID 13918
4'-Bromo-2-chlorobenzanilide
CID 221829
N-(4-Chlorophenyl)-3-oxo-3-phenylpropanamide
CID 570768
Benzamide, N-(4-bromophenyl)-
CID 101357
N-(3-chlorophenyl)-3-fluorobenzamide
CID 532008
2-bromo-N-(3-chlorophenyl)benzamide
CID 532188
N-(4-bromophenyl)-2-(3-chlorophenyl)acetamide
CID 758119
N-(3-Chloro-4-fluorophenyl)benzamide
CID 569594
3-bromo-N-(3-chlorophenyl)benzamide
CID 531997

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide?
The IUPAC name of 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide (CID 4565122) is 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide.
What is the SMILES notation for 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide?
The canonical SMILES for 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide is O=C(Nc1ccc(Cl)cc1)c1ccc(Br)cc1F.
What is the InChIKey of 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide?
The InChIKey is FSBRTBVTIRFXOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrClFNO/c14-8-1-6-11(12(16)7-8)13(18)17-10-4-2-9(15)3-5-10/h1-7H,(H,17,18).
What are the key properties of 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide?
4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide has a molecular weight of 328.57 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(4-chlorophenyl)-2-fluorobenzamide is sourced from PubChem (CID 4565122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).