5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine

C21H12F3N3 — CID 10384086

IUPAC5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine
SMILESFc1ccccc1-c1cc(-c2ccc(F)c(-c3ncccc3F)c2)cnn1
InChIInChI=1S/C21H12F3N3/c22-17-5-2-1-4-15(17)20-11-14(12-26-27-20)13-7-8-18(23)16(10-13)21-19(24)6-3-9-25-21/h1-12H
InChIKeyUJBOQYCZTOTBAN-UHFFFAOYSA-N
MW363.34 g/mol
LogP5.29
Rot. Bonds3

About 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine

5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine (PubChem CID 10384086) has the molecular formula C21H12F3N3 and a molecular weight of 363.34 g/mol. Its IUPAC name is 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine.

Molecular Properties

Compound Name5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine
PubChem CID10384086
Molecular FormulaC21H12F3N3
Molecular Weight363.34 g/mol
Exact Mass363.10
IUPAC Name5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine
SMILESFc1ccccc1-c1cc(-c2ccc(F)c(-c3ncccc3F)c2)cnn1
InChIInChI=1S/C21H12F3N3/c22-17-5-2-1-4-15(17)20-11-14(12-26-27-20)13-7-8-18(23)16(10-13)21-19(24)6-3-9-25-21/h1-12H
InChIKeyUJBOQYCZTOTBAN-UHFFFAOYSA-N
XLogP5.29
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.34
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine 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 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine?
The IUPAC name of 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine (CID 10384086) is 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine.
What is the SMILES notation for 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine?
The canonical SMILES for 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine is Fc1ccccc1-c1cc(-c2ccc(F)c(-c3ncccc3F)c2)cnn1.
What is the InChIKey of 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine?
The InChIKey is UJBOQYCZTOTBAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H12F3N3/c22-17-5-2-1-4-15(17)20-11-14(12-26-27-20)13-7-8-18(23)16(10-13)21-19(24)6-3-9-25-21/h1-12H.
What are the key properties of 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine?
5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine has a molecular weight of 363.34 g/mol, XLogP of 5.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]-3-(2-fluorophenyl)pyridazine is sourced from PubChem (CID 10384086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).