Basic information
- CAS
887475-71-0- Standard SMILES
CSc1nc(Br)cn2ccnc12- InChIKey
HWUMJZFDFAFXKB-UHFFFAOYSA-N- Molecular formula
- C7H6BrN3S
- Average molar mass
- 244.11 g/mol
- Monoisotopic mass
- 242.94658029
Names & identifiers
- Preferred name
- 6-Bromo-8-(methylthio)imidazo[1,2-A]pyrazine
- IUPAC
- 6-bromo-8-methylsulfanylimidazo[1,2-a]pyrazine
- English name
- 6-BROMO-8-(METHYLTHIO)IMIDAZO[1,2-A]PYRAZINE
- Molecular formula
- C7H6BrN3S
- Molecular weight
- 244.11
Names & synonyms
887475-71-06-BROMO-8-(METHYLTHIO)IMIDAZO[1,2-A]PYRAZINE6-Bromo-8-methylthioimidazo[1,2-a]pyrazinamine6-bromo-8-methylsulfanylimidazo[1,2-a]pyrazine6-Bromo-8-methylsulfanyl-imidazo[1,2-a]pyrazineMFCD111000036-Bromo-8-(methylsulfanyl)imidazo[1,2-a]pyrazine6-Bromo-8-(methylthio)6-bromo-8-(methylthio)-Imidazo[1,2-a]pyrazineImidazo[1,2-a]pyrazine, 6-bromo-8-(methylthio)-SCHEMBL104884DTXSID70693105
Show more names
HWUMJZFDFAFXKB-UHFFFAOYSA-NCS-M3158AKOS016002675AS-36141SY240552DB-078152F220405
Database identifiers
- CAS
887475-71-0- PubChem CID
- 53249869
- DTXSID
DTXSID70693105- Nikkaji
- J3.141.242K
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Density
- 1.81 · 1.81
- storage temp.
- 2 · Storage temp. 2-8°C
- pka
- 1.46 · 1.46±0.30(Predicted)
- Appearance
- Light brown to brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers23 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
skychemical Co.Ltd021-20958197 20965099 · [email protected]
上海先诺生物科技有限公司021-50718719 13918719472
台州南峰药物研究所[email protected] 18616377689 · [email protected]
上海宸香医药科技有限公司021-20960837 · [email protected]
南通博苏医药科技有限公司0513-51005092; 15962844273 · [email protected]
天津安浩生物科技有限公司[email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
上海天习化工有限公司021-20960837,QQ1332204249 · [email protected]
上海珂臻医药科技有限公司021-021-021-31663258 13795219287 · [email protected]
Related reactions
3 records
Compound notes
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