6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine

C15H10ClN3O2 — CID 71491930

IUPAC6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine
SMILESCOc1ccc2oc(-c3cnc4ccc(Cl)nn34)cc2c1
InChIInChI=1S/C15H10ClN3O2/c1-20-10-2-3-12-9(6-10)7-13(21-12)11-8-17-15-5-4-14(16)18-19(11)15/h2-8H,1H3
InChIKeyRGIVPDANRFTKOV-UHFFFAOYSA-N
MW299.72 g/mol
LogP3.80
Rot. Bonds2

About 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine

6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine (PubChem CID 71491930) has the molecular formula C15H10ClN3O2 and a molecular weight of 299.72 g/mol. Its IUPAC name is 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine
PubChem CID71491930
Molecular FormulaC15H10ClN3O2
Molecular Weight299.72 g/mol
Exact Mass299.05
IUPAC Name6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine
SMILESCOc1ccc2oc(-c3cnc4ccc(Cl)nn34)cc2c1
InChIInChI=1S/C15H10ClN3O2/c1-20-10-2-3-12-9(6-10)7-13(21-12)11-8-17-15-5-4-14(16)18-19(11)15/h2-8H,1H3
InChIKeyRGIVPDANRFTKOV-UHFFFAOYSA-N
XLogP3.80
TPSA52.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.72
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine?
The IUPAC name of 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine (CID 71491930) is 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine is COc1ccc2oc(-c3cnc4ccc(Cl)nn34)cc2c1.
What is the InChIKey of 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine?
The InChIKey is RGIVPDANRFTKOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3O2/c1-20-10-2-3-12-9(6-10)7-13(21-12)11-8-17-15-5-4-14(16)18-19(11)15/h2-8H,1H3.
What are the key properties of 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine?
6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine has a molecular weight of 299.72 g/mol, XLogP of 3.80, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(5-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 71491930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).