4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol

C26H19FN4O3 — CID 143237170

IUPAC4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol
SMILESCOc1cc2c(Oc3ccc(-c4ccc(Nc5ccccc5)nn4)cc3F)ccnc2cc1O
InChIInChI=1S/C26H19FN4O3/c1-33-25-14-18-21(15-22(25)32)28-12-11-23(18)34-24-9-7-16(13-19(24)27)20-8-10-26(31-30-20)29-17-5-3-2-4-6-17/h2-15,32H,1H3,(H,29,31)
InChIKeyJMUPQAOIAZHIHV-UHFFFAOYSA-N
MW454.46 g/mol
LogP6.08
Rot. Bonds6

About 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol

4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol (PubChem CID 143237170) has the molecular formula C26H19FN4O3 and a molecular weight of 454.46 g/mol. Its IUPAC name is 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol.

Molecular Properties

Compound Name4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol
PubChem CID143237170
Molecular FormulaC26H19FN4O3
Molecular Weight454.46 g/mol
Exact Mass454.14
IUPAC Name4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol
SMILESCOc1cc2c(Oc3ccc(-c4ccc(Nc5ccccc5)nn4)cc3F)ccnc2cc1O
InChIInChI=1S/C26H19FN4O3/c1-33-25-14-18-21(15-22(25)32)28-12-11-23(18)34-24-9-7-16(13-19(24)27)20-8-10-26(31-30-20)29-17-5-3-2-4-6-17/h2-15,32H,1H3,(H,29,31)
InChIKeyJMUPQAOIAZHIHV-UHFFFAOYSA-N
XLogP6.08
TPSA89.39 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.46
LogP ≤ 56.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol 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

6-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-N-phenylpyridazin-3-amine
CID 11857506
4-(4-amino-2-fluorophenoxy)-7-methoxyquinolin-6-ol
CID 67522286
4-(2-fluoro-4-pyrimidin-5-ylphenoxy)-6,7-dimethoxyquinoline
CID 141201268
4-[3-fluoro-4-(4-propan-2-ylanilino)phenoxy]-6-methoxyquinolin-7-ol
CID 142235099
N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-4-phenylaniline
CID 23022656
4-(6,7-dimethoxyquinolin-4-yl)oxy-N-ethyl-3-fluoroaniline
CID 67457884
5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]-2-(3-fluoroanilino)-3-methylpyrimidin-4-one
CID 11858025
4-(4-chloro-2-fluorophenoxy)-7-methoxyquinoline-6-carboxylic acid
CID 11268045
4-(3-fluoro-4-nitrophenoxy)-6-methoxyquinolin-7-ol
CID 135621708
5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]-3-methyl-2-[(1R)-1-phenylethyl]pyrimidin-4-one
CID 11857352
5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]-3-methyl-2-(N-methylanilino)pyrimidin-4-one
CID 11858193
N-[[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]carbamoyl]-2-ethylbenzamide
CID 59864354

Frequently Asked Questions

What is the IUPAC name of 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol?
The IUPAC name of 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol (CID 143237170) is 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol.
What is the SMILES notation for 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol?
The canonical SMILES for 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol is COc1cc2c(Oc3ccc(-c4ccc(Nc5ccccc5)nn4)cc3F)ccnc2cc1O.
What is the InChIKey of 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol?
The InChIKey is JMUPQAOIAZHIHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19FN4O3/c1-33-25-14-18-21(15-22(25)32)28-12-11-23(18)34-24-9-7-16(13-19(24)27)20-8-10-26(31-30-20)29-17-5-3-2-4-6-17/h2-15,32H,1H3,(H,29,31).
What are the key properties of 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol?
4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol has a molecular weight of 454.46 g/mol, XLogP of 6.08, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(6-anilinopyridazin-3-yl)-2-fluorophenoxy]-6-methoxyquinolin-7-ol is sourced from PubChem (CID 143237170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).