Home > Compound List > Compound details
1025976-69-5 molecular structure
click picture or here to close

8-bromo-6-methylimidazo[1,2-a]pyrazine

ChemBase ID: 90921
Molecular Formular: C7H6BrN3
Molecular Mass: 212.04664
Monoisotopic Mass: 210.97450921
SMILES and InChIs

SMILES:
n12cc(nc(c1ncc2)Br)C
Canonical SMILES:
Cc1cn2ccnc2c(n1)Br
InChI:
InChI=1S/C7H6BrN3/c1-5-4-11-3-2-9-7(11)6(8)10-5/h2-4H,1H3
InChIKey:
ISUGJROMRCUXOH-UHFFFAOYSA-N

Cite this record

CBID:90921 http://www.chembase.cn/molecule-90921.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
8-bromo-6-methylimidazo[1,2-a]pyrazine
IUPAC Traditional name
8-bromo-6-methylimidazo[1,2-a]pyrazine
Synonyms
8-Bromo-6-methylimidazo[1,2-a]pyrazine
CAS Number
1025976-69-5
PubChem SID
162077625
PubChem CID
10330802

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Apollo Scientific
OR63023 external link Add to cart Please log in.
Data Source Data ID
PubChem 10330802 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.49746862  LogD (pH = 7.4) 0.6451837 
Log P 0.6475218  Molar Refractivity 46.836 cm3
Polarizability 17.124474 Å3 Polar Surface Area 30.19 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Bioassay(PubChem)
Storage Warning
Harmful/Irritant/Light Sensitive expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle