5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine

C7H3BrF3N3 — CID 82379830

IUPAC5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine
SMILESFC(F)(F)c1nc(Br)c2cccnn12
InChIInChI=1S/C7H3BrF3N3/c8-5-4-2-1-3-12-14(4)6(13-5)7(9,10)11/h1-3H
InChIKeyYGGVMDSWCQQWNJ-UHFFFAOYSA-N
MW266.02 g/mol
LogP2.51
Rot. Bonds

About 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine

5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine (PubChem CID 82379830) has the molecular formula C7H3BrF3N3 and a molecular weight of 266.02 g/mol. Its IUPAC name is 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine.

Molecular Properties

Compound Name5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine
PubChem CID82379830
Molecular FormulaC7H3BrF3N3
Molecular Weight266.02 g/mol
Exact Mass264.95
IUPAC Name5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine
SMILESFC(F)(F)c1nc(Br)c2cccnn12
InChIInChI=1S/C7H3BrF3N3/c8-5-4-2-1-3-12-14(4)6(13-5)7(9,10)11/h1-3H
InChIKeyYGGVMDSWCQQWNJ-UHFFFAOYSA-N
XLogP2.51
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.02
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,7-dibromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine
CID 84745242
1-bromo-3-tert-butylimidazo[1,5-a]pyridine
CID 4738514
5-iodo-7-methylimidazo[1,5-b]pyridazine
CID 130115034
5-bromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743818
6-bromo-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 87178764
3-bromo-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 118094539
2-[4-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazin-3-amine
CID 154511923
1-bromo-3-tert-butylimidazo[1,5-a]pyridin-5-amine
CID 83844677
(3-bromoimidazo[1,2-b]pyridazin-2-yl)methanol
CID 84691656
1-(4,6-dichloro-1,3,5-triazin-2-yl)-2-(trifluoromethyl)benzimidazole
CID 824435
1-propan-2-yl-2-(trifluoromethyl)benzimidazole
CID 888592
3-[4-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazine
CID 176715171

Frequently Asked Questions

What is the IUPAC name of 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine?
The IUPAC name of 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine (CID 82379830) is 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine.
What is the SMILES notation for 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine?
The canonical SMILES for 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine is FC(F)(F)c1nc(Br)c2cccnn12.
What is the InChIKey of 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine?
The InChIKey is YGGVMDSWCQQWNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3BrF3N3/c8-5-4-2-1-3-12-14(4)6(13-5)7(9,10)11/h1-3H.
What are the key properties of 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine?
5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine has a molecular weight of 266.02 g/mol, XLogP of 2.51, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-7-(trifluoromethyl)imidazo[1,5-b]pyridazine is sourced from PubChem (CID 82379830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).