4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide

C17H13N3O4 — CID 54691068

IUPAC4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide
SMILESNC(=O)c1nn(-c2ccc(Oc3ccccc3)cc2)c(=O)cc1O
InChIInChI=1S/C17H13N3O4/c18-17(23)16-14(21)10-15(22)20(19-16)11-6-8-13(9-7-11)24-12-4-2-1-3-5-12/h1-10,21H,(H2,18,23)
InChIKeyZJEPNINFDREESI-UHFFFAOYSA-N
MW323.31 g/mol
LogP1.83
Rot. Bonds4

About 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide

4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide (PubChem CID 54691068) has the molecular formula C17H13N3O4 and a molecular weight of 323.31 g/mol. Its IUPAC name is 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide
PubChem CID54691068
Molecular FormulaC17H13N3O4
Molecular Weight323.31 g/mol
Exact Mass323.09
IUPAC Name4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide
SMILESNC(=O)c1nn(-c2ccc(Oc3ccccc3)cc2)c(=O)cc1O
InChIInChI=1S/C17H13N3O4/c18-17(23)16-14(21)10-15(22)20(19-16)11-6-8-13(9-7-11)24-12-4-2-1-3-5-12/h1-10,21H,(H2,18,23)
InChIKeyZJEPNINFDREESI-UHFFFAOYSA-N
XLogP1.83
TPSA107.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.31
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide?
The IUPAC name of 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide (CID 54691068) is 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide is NC(=O)c1nn(-c2ccc(Oc3ccccc3)cc2)c(=O)cc1O.
What is the InChIKey of 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide?
The InChIKey is ZJEPNINFDREESI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O4/c18-17(23)16-14(21)10-15(22)20(19-16)11-6-8-13(9-7-11)24-12-4-2-1-3-5-12/h1-10,21H,(H2,18,23).
What are the key properties of 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide?
4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide has a molecular weight of 323.31 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-oxo-1-(4-phenoxyphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 54691068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).