6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine

C12H6BrF2N3O — CID 79955215

IUPAC6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine
SMILESFc1cccc(Oc2nc(Br)cn3ccnc23)c1F
InChIInChI=1S/C12H6BrF2N3O/c13-9-6-18-5-4-16-11(18)12(17-9)19-8-3-1-2-7(14)10(8)15/h1-6H
InChIKeyZXOJGTIZVOKFDJ-UHFFFAOYSA-N
MW326.10 g/mol
LogP3.56
Rot. Bonds2

About 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine

6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine (PubChem CID 79955215) has the molecular formula C12H6BrF2N3O and a molecular weight of 326.10 g/mol. Its IUPAC name is 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine
PubChem CID79955215
Molecular FormulaC12H6BrF2N3O
Molecular Weight326.10 g/mol
Exact Mass324.97
IUPAC Name6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine
SMILESFc1cccc(Oc2nc(Br)cn3ccnc23)c1F
InChIInChI=1S/C12H6BrF2N3O/c13-9-6-18-5-4-16-11(18)12(17-9)19-8-3-1-2-7(14)10(8)15/h1-6H
InChIKeyZXOJGTIZVOKFDJ-UHFFFAOYSA-N
XLogP3.56
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.10
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine?
The IUPAC name of 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine (CID 79955215) is 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine?
The canonical SMILES for 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine is Fc1cccc(Oc2nc(Br)cn3ccnc23)c1F.
What is the InChIKey of 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine?
The InChIKey is ZXOJGTIZVOKFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6BrF2N3O/c13-9-6-18-5-4-16-11(18)12(17-9)19-8-3-1-2-7(14)10(8)15/h1-6H.
What are the key properties of 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine?
6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine has a molecular weight of 326.10 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-(2,3-difluorophenoxy)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 79955215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).