6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid

C11H6Cl2N2O2 — CID 97180483

IUPAC6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid
SMILESO=C(O)c1cc(Cl)nnc1-c1ccc(Cl)cc1
InChIInChI=1S/C11H6Cl2N2O2/c12-7-3-1-6(2-4-7)10-8(11(16)17)5-9(13)14-15-10/h1-5H,(H,16,17)
InChIKeyVAXZXMXRNKCGSU-UHFFFAOYSA-N
MW269.09 g/mol
LogP3.15
Rot. Bonds2

About 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid

6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid (PubChem CID 97180483) has the molecular formula C11H6Cl2N2O2 and a molecular weight of 269.09 g/mol. Its IUPAC name is 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid.

Molecular Properties

Compound Name6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid
PubChem CID97180483
Molecular FormulaC11H6Cl2N2O2
Molecular Weight269.09 g/mol
Exact Mass267.98
IUPAC Name6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid
SMILESO=C(O)c1cc(Cl)nnc1-c1ccc(Cl)cc1
InChIInChI=1S/C11H6Cl2N2O2/c12-7-3-1-6(2-4-7)10-8(11(16)17)5-9(13)14-15-10/h1-5H,(H,16,17)
InChIKeyVAXZXMXRNKCGSU-UHFFFAOYSA-N
XLogP3.15
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.09
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic 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

2-amino-4-(4-chlorophenyl)pyrimidine-5-carboxylic acid
CID 75488589
3-chloro-6-(4-chlorophenyl)-5-fluoropyridine-2-carboxylic acid
CID 141310101
2-chloro-4-(2,5-dichlorophenyl)benzoic acid
CID 53227705
6-(4-chlorophenyl)-5-methyl-2-(methylamino)pyridine-3-carboxylic acid
CID 94285501
2-carbamoyl-5-chlorobenzoic acid
CID 57087443
2-(4-chlorophenyl)pyridine-3-carboxamide
CID 140983292
5-(4-chlorophenyl)-2H-triazole-4-carboxylic acid
CID 82372862
1,4-dichlorobenzene;phthalic acid
CID 146444395
5-(4-carboxy-3-fluorophenyl)-2-chloropyridine-4-carboxylic acid
CID 53223834
3-(4-chlorophenyl)-6-oxo-1H-pyridazine-5-carboxylic acid
CID 82445716
5-(4-chlorophenyl)-6-(4-methylphenyl)pyrazine-2,3-dicarboxylic acid
CID 69141126
4-(3-carbamoyl-4-chlorophenyl)-2-chlorobenzoic acid
CID 53228066

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid?
The IUPAC name of 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid (CID 97180483) is 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid.
What is the SMILES notation for 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid?
The canonical SMILES for 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid is O=C(O)c1cc(Cl)nnc1-c1ccc(Cl)cc1.
What is the InChIKey of 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid?
The InChIKey is VAXZXMXRNKCGSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Cl2N2O2/c12-7-3-1-6(2-4-7)10-8(11(16)17)5-9(13)14-15-10/h1-5H,(H,16,17).
What are the key properties of 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid?
6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid has a molecular weight of 269.09 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(4-chlorophenyl)pyridazine-4-carboxylic acid is sourced from PubChem (CID 97180483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).