3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine

C12H7BrFN3 — CID 66812841

IUPAC3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine
SMILESFc1cccc(-c2cnn3c(Br)cnc3c2)c1
InChIInChI=1S/C12H7BrFN3/c13-11-7-15-12-5-9(6-16-17(11)12)8-2-1-3-10(14)4-8/h1-7H
InChIKeyVFMWZCMCZBDASN-UHFFFAOYSA-N
MW292.11 g/mol
LogP3.30
Rot. Bonds1

About 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine

3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine (PubChem CID 66812841) has the molecular formula C12H7BrFN3 and a molecular weight of 292.11 g/mol. Its IUPAC name is 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine
PubChem CID66812841
Molecular FormulaC12H7BrFN3
Molecular Weight292.11 g/mol
Exact Mass290.98
IUPAC Name3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine
SMILESFc1cccc(-c2cnn3c(Br)cnc3c2)c1
InChIInChI=1S/C12H7BrFN3/c13-11-7-15-12-5-9(6-16-17(11)12)8-2-1-3-10(14)4-8/h1-7H
InChIKeyVFMWZCMCZBDASN-UHFFFAOYSA-N
XLogP3.30
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.11
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine (CID 66812841) is 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine is Fc1cccc(-c2cnn3c(Br)cnc3c2)c1.
What is the InChIKey of 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine?
The InChIKey is VFMWZCMCZBDASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7BrFN3/c13-11-7-15-12-5-9(6-16-17(11)12)8-2-1-3-10(14)4-8/h1-7H.
What are the key properties of 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine?
3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine has a molecular weight of 292.11 g/mol, XLogP of 3.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 66812841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).