6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide

C10H13FN4O2S — CID 67266139

IUPAC6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide
SMILESCCCCc1ccc2nc(F)c(S(N)(=O)=O)n2n1
InChIInChI=1S/C10H13FN4O2S/c1-2-3-4-7-5-6-8-13-9(11)10(15(8)14-7)18(12,16)17/h5-6H,2-4H2,1H3,(H2,12,16,17)
InChIKeyDVOGTFNJRVJXFH-UHFFFAOYSA-N
MW272.31 g/mol
LogP0.86
Rot. Bonds4

About 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide

6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide (PubChem CID 67266139) has the molecular formula C10H13FN4O2S and a molecular weight of 272.31 g/mol. Its IUPAC name is 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide.

Molecular Properties

Compound Name6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide
PubChem CID67266139
Molecular FormulaC10H13FN4O2S
Molecular Weight272.31 g/mol
Exact Mass272.07
IUPAC Name6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide
SMILESCCCCc1ccc2nc(F)c(S(N)(=O)=O)n2n1
InChIInChI=1S/C10H13FN4O2S/c1-2-3-4-7-5-6-8-13-9(11)10(15(8)14-7)18(12,16)17/h5-6H,2-4H2,1H3,(H2,12,16,17)
InChIKeyDVOGTFNJRVJXFH-UHFFFAOYSA-N
XLogP0.86
TPSA90.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide?
The IUPAC name of 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide (CID 67266139) is 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide.
What is the SMILES notation for 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide?
The canonical SMILES for 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide is CCCCc1ccc2nc(F)c(S(N)(=O)=O)n2n1.
What is the InChIKey of 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide?
The InChIKey is DVOGTFNJRVJXFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN4O2S/c1-2-3-4-7-5-6-8-13-9(11)10(15(8)14-7)18(12,16)17/h5-6H,2-4H2,1H3,(H2,12,16,17).
What are the key properties of 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide?
6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide has a molecular weight of 272.31 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butyl-2-fluoroimidazo[1,2-b]pyridazine-3-sulfonamide is sourced from PubChem (CID 67266139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).