(6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone

C13H8ClN3O — CID 2774636

IUPAC(6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1cnc2ccc(Cl)nn12
InChIInChI=1S/C13H8ClN3O/c14-11-6-7-12-15-8-10(17(12)16-11)13(18)9-4-2-1-3-5-9/h1-8H
InChIKeyDWEXNPGMMTWOKC-UHFFFAOYSA-N
MW257.68 g/mol
LogP2.61
Rot. Bonds2

About (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone

(6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone (PubChem CID 2774636) has the molecular formula C13H8ClN3O and a molecular weight of 257.68 g/mol. Its IUPAC name is (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone.

Molecular Properties

Compound Name(6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone
PubChem CID2774636
Molecular FormulaC13H8ClN3O
Molecular Weight257.68 g/mol
Exact Mass257.04
IUPAC Name(6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1cnc2ccc(Cl)nn12
InChIInChI=1S/C13H8ClN3O/c14-11-6-7-12-15-8-10(17(12)16-11)13(18)9-4-2-1-3-5-9/h1-8H
InChIKeyDWEXNPGMMTWOKC-UHFFFAOYSA-N
XLogP2.61
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.68
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone 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

7-(2-(1H-Imidazol-1-yl)-5-methylimidazo(1,5-b)pyridazin-7-yl)-1-phenyl-1-heptanone
CID 189892
7-(5-Methylimidazo[1,5-b]pyridazin-7-yl)-1-phenyl-1-heptanone
CID 455577
US10077269, Example 104
CID 118875388
(4-Chlorophenyl)(7-methylimidazo(1,2-A)pyridin-3-YL)methanone
CID 3776081
1-Heptanone, 7-(2-chloro-5-methylimidazo(1,5-b)pyridazin-7-yl)-1-phenyl-
CID 455565
7-(2-Chloroimidazo[1,5-b]pyridazin-7-yl)-1-heptanone
CID 455574
7-[5-Methyl-2-(1-pyrrolyl)imidazo[1,5-b]pyridazin-7-yl]-1-phenyl-1-heptanone
CID 455585
7-[2-(5-Methylimidazol-1-yl)-5-methylimidazo[1,5-b]pyridazin-7-yl]-1-phenyl-1-heptanone
CID 455591
7-[2-(4-Methylimidazol-1-yl)-5-methylimidazo[1,5-b]pyridazin-7-yl]-1-phenyl-1-heptanone
CID 455592
7-[2-(2-Methylimidazol-1-yl)-5-methylimidazo[1,5-b]pyridazin-7-yl]-1-phenyl-1-heptanone
CID 455593
Aminoimidazo[1,2-a]pyridine deriv. 15
CID 5330615
Aminoimidazo[1,2-a]pyridine deriv. 42
CID 5330618

Frequently Asked Questions

What is the IUPAC name of (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone?
The IUPAC name of (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone (CID 2774636) is (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone.
What is the SMILES notation for (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone?
The canonical SMILES for (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone is O=C(c1ccccc1)c1cnc2ccc(Cl)nn12.
What is the InChIKey of (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone?
The InChIKey is DWEXNPGMMTWOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClN3O/c14-11-6-7-12-15-8-10(17(12)16-11)13(18)9-4-2-1-3-5-9/h1-8H.
What are the key properties of (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone?
(6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone has a molecular weight of 257.68 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloroimidazo[1,2-b]pyridazin-3-yl)-phenylmethanone is sourced from PubChem (CID 2774636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).