4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid

C16H10ClNO3 — CID 167888725

IUPAC4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid
SMILESO=C(O)c1ccc(-c2ccnc3cc(Cl)ccc23)cc1O
InChIInChI=1S/C16H10ClNO3/c17-10-2-4-12-11(5-6-18-14(12)8-10)9-1-3-13(16(20)21)15(19)7-9/h1-8,19H,(H,20,21)
InChIKeyVIJAUFVSJXFFFP-UHFFFAOYSA-N
MW299.71 g/mol
LogP3.96
Rot. Bonds2

About 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid

4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid (PubChem CID 167888725) has the molecular formula C16H10ClNO3 and a molecular weight of 299.71 g/mol. Its IUPAC name is 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid.

Molecular Properties

Compound Name4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid
PubChem CID167888725
Molecular FormulaC16H10ClNO3
Molecular Weight299.71 g/mol
Exact Mass299.03
IUPAC Name4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid
SMILESO=C(O)c1ccc(-c2ccnc3cc(Cl)ccc23)cc1O
InChIInChI=1S/C16H10ClNO3/c17-10-2-4-12-11(5-6-18-14(12)8-10)9-1-3-13(16(20)21)15(19)7-9/h1-8,19H,(H,20,21)
InChIKeyVIJAUFVSJXFFFP-UHFFFAOYSA-N
XLogP3.96
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.71
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic 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-(2,4-dichlorophenyl)-2-hydroxybenzoic acid
CID 53227675
N-[2-[[5-(7-chloroquinolin-4-yl)-2-hydroxyphenyl]methylamino]ethyl]acetamide
CID 136967880
4-(7-chloroquinolin-4-yl)-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenol
CID 135858729
4-(7-chloroquinolin-4-yl)-2-[[(2S)-2-methylpiperidin-1-yl]methyl]phenol
CID 135888232
4-(7-chloroquinolin-4-yl)-2-[[(2R)-2-methylpiperidin-1-yl]methyl]phenol
CID 135888231
4-bromo-7-chloroquinoline-3-carboxylic acid
CID 97033495
6-chloro-7-hydroxyquinoline-4-carboxylic acid
CID 165460215
4-[4-[(7-chloroquinolin-4-yl)amino]phenyl]benzoic acid
CID 24757093
4-chloro-2-quinolin-5-ylbenzoic acid
CID 107989819
4-(7-chloroquinolin-4-yl)-2-[[3-(hydroxymethyl)piperidin-1-yl]methyl]phenol
CID 135988270
2-hydroxy-4-pyridin-4-ylbenzoic acid
CID 22710668
4-(3,4-difluorophenyl)-2-hydroxybenzoic acid
CID 53225879

Frequently Asked Questions

What is the IUPAC name of 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid?
The IUPAC name of 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid (CID 167888725) is 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid.
What is the SMILES notation for 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid?
The canonical SMILES for 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid is O=C(O)c1ccc(-c2ccnc3cc(Cl)ccc23)cc1O.
What is the InChIKey of 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid?
The InChIKey is VIJAUFVSJXFFFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClNO3/c17-10-2-4-12-11(5-6-18-14(12)8-10)9-1-3-13(16(20)21)15(19)7-9/h1-8,19H,(H,20,21).
What are the key properties of 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid?
4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid has a molecular weight of 299.71 g/mol, XLogP of 3.96, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-chloroquinolin-4-yl)-2-hydroxybenzoic acid is sourced from PubChem (CID 167888725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).