6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine

C10H6BrN5S — CID 79947658

IUPAC6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine
SMILESBrc1cn2ccnc2c(Sc2ncccn2)n1
InChIInChI=1S/C10H6BrN5S/c11-7-6-16-5-4-12-8(16)9(15-7)17-10-13-2-1-3-14-10/h1-6H
InChIKeyCFYSITIEMOJHKW-UHFFFAOYSA-N
MW308.16 g/mol
LogP2.43
Rot. Bonds2

About 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine

6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine (PubChem CID 79947658) has the molecular formula C10H6BrN5S and a molecular weight of 308.16 g/mol. Its IUPAC name is 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine
PubChem CID79947658
Molecular FormulaC10H6BrN5S
Molecular Weight308.16 g/mol
Exact Mass306.95
IUPAC Name6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine
SMILESBrc1cn2ccnc2c(Sc2ncccn2)n1
InChIInChI=1S/C10H6BrN5S/c11-7-6-16-5-4-12-8(16)9(15-7)17-10-13-2-1-3-14-10/h1-6H
InChIKeyCFYSITIEMOJHKW-UHFFFAOYSA-N
XLogP2.43
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.16
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine?
The IUPAC name of 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine (CID 79947658) is 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine?
The canonical SMILES for 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine is Brc1cn2ccnc2c(Sc2ncccn2)n1.
What is the InChIKey of 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine?
The InChIKey is CFYSITIEMOJHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrN5S/c11-7-6-16-5-4-12-8(16)9(15-7)17-10-13-2-1-3-14-10/h1-6H.
What are the key properties of 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine?
6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine has a molecular weight of 308.16 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 79947658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).