Basic information
- Standard SMILES
COCn1nc2c(I)c(Br)ccn2c1=O- InChIKey
HFOYVRZWRZNWMI-UHFFFAOYSA-N- Molecular formula
- C8H7BrIN3O2
- Average molar mass
- 383.97 g/mol
Names & identifiers
- Preferred name
- 7-bromo-8-iodo-2-(methoxymethyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
- IUPAC
- 7-bromo-8-iodo-2-(methoxymethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-one
Names & synonyms
SCHEMBL4465094HFOYVRZWRZNWMI-UHFFFAOYSA-NDB-2079937-Bromo-8-iodo-2-(methoxymethyl)-1,2,4-triazolo[4,3-a]pyridin-3(2h)-one7-bromo-8-iodo-2-(methoxymethyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one917969-54-1
Database identifiers
- PubChem CID
- 57799432
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 45.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 405
Related reactions
3 records
Compound notes
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