4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid

C14H9ClFNO4 — CID 107674641

IUPAC4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
SMILESO=C(Nc1cc(Cl)ccc1C(=O)O)c1ccc(O)cc1F
InChIInChI=1S/C14H9ClFNO4/c15-7-1-3-10(14(20)21)12(5-7)17-13(19)9-4-2-8(18)6-11(9)16/h1-6,18H,(H,17,19)(H,20,21)
InChIKeyIMWUVTJVRZNKEV-UHFFFAOYSA-N
MW309.68 g/mol
LogP3.14
Rot. Bonds3

About 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid

4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid (PubChem CID 107674641) has the molecular formula C14H9ClFNO4 and a molecular weight of 309.68 g/mol. Its IUPAC name is 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid.

Molecular Properties

Compound Name4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
PubChem CID107674641
Molecular FormulaC14H9ClFNO4
Molecular Weight309.68 g/mol
Exact Mass309.02
IUPAC Name4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
SMILESO=C(Nc1cc(Cl)ccc1C(=O)O)c1ccc(O)cc1F
InChIInChI=1S/C14H9ClFNO4/c15-7-1-3-10(14(20)21)12(5-7)17-13(19)9-4-2-8(18)6-11(9)16/h1-6,18H,(H,17,19)(H,20,21)
InChIKeyIMWUVTJVRZNKEV-UHFFFAOYSA-N
XLogP3.14
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.68
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid 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

4-chloro-2-[(2-chloro-5-hydroxybenzoyl)amino]benzoic acid
CID 106500157
4-amino-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674554
4-bromo-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674764
5-fluoro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674704
4-chloro-3-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674694
4-chloro-2-[(3,5-dihydroxybenzoyl)amino]benzoic acid
CID 107702304
3-[(2-fluoro-4-hydroxybenzoyl)amino]-2-hydroxybenzoic acid
CID 107675143
4-chloro-2-[(2-fluoro-5-methylbenzoyl)amino]benzoic acid
CID 62516513
5-bromo-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674832
2-[(4-chloro-2-hydroxybenzoyl)amino]-5-hydroxybenzoic acid
CID 61405727
N-(5-chloro-2-fluorophenyl)-2,4-difluorobenzamide
CID 7899666
5-chloro-N-(2-fluoro-4-hydroxyphenyl)-2-hydroxybenzamide
CID 64793866

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid?
The IUPAC name of 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid (CID 107674641) is 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid.
What is the SMILES notation for 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid?
The canonical SMILES for 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid is O=C(Nc1cc(Cl)ccc1C(=O)O)c1ccc(O)cc1F.
What is the InChIKey of 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid?
The InChIKey is IMWUVTJVRZNKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClFNO4/c15-7-1-3-10(14(20)21)12(5-7)17-13(19)9-4-2-8(18)6-11(9)16/h1-6,18H,(H,17,19)(H,20,21).
What are the key properties of 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid?
4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid has a molecular weight of 309.68 g/mol, XLogP of 3.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid is sourced from PubChem (CID 107674641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).