3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine

C7H5Cl2F2N3 — CID 172561458

IUPAC3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine
SMILESFC1(F)CN(c2cc(Cl)nnc2Cl)C1
InChIInChI=1S/C7H5Cl2F2N3/c8-5-1-4(6(9)13-12-5)14-2-7(10,11)3-14/h1H,2-3H2
InChIKeyCLEVSJUWBIQRBB-UHFFFAOYSA-N
MW240.04 g/mol
LogP2.24
Rot. Bonds1

About 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine

3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine (PubChem CID 172561458) has the molecular formula C7H5Cl2F2N3 and a molecular weight of 240.04 g/mol. Its IUPAC name is 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine.

Molecular Properties

Compound Name3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine
PubChem CID172561458
Molecular FormulaC7H5Cl2F2N3
Molecular Weight240.04 g/mol
Exact Mass238.98
IUPAC Name3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine
SMILESFC1(F)CN(c2cc(Cl)nnc2Cl)C1
InChIInChI=1S/C7H5Cl2F2N3/c8-5-1-4(6(9)13-12-5)14-2-7(10,11)3-14/h1H,2-3H2
InChIKeyCLEVSJUWBIQRBB-UHFFFAOYSA-N
XLogP2.24
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.04
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)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 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine?
The IUPAC name of 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine (CID 172561458) is 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine.
What is the SMILES notation for 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine?
The canonical SMILES for 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine is FC1(F)CN(c2cc(Cl)nnc2Cl)C1.
What is the InChIKey of 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine?
The InChIKey is CLEVSJUWBIQRBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2F2N3/c8-5-1-4(6(9)13-12-5)14-2-7(10,11)3-14/h1H,2-3H2.
What are the key properties of 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine?
3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine has a molecular weight of 240.04 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-4-(3,3-difluoroazetidin-1-yl)pyridazine is sourced from PubChem (CID 172561458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).