Basic information
- Standard SMILES
CC1=NCN(c2ccc(Br)s2)O1- InChIKey
RIWOYRZHDAJAJV-UHFFFAOYSA-N- Molecular formula
- C7H7BrN2OS
- Average molar mass
- 247.11 g/mol
- Monoisotopic mass
- 245.94625
Names & identifiers
- Preferred name
- 2-Bromo-5-(5-methyl-[1,2,4]oxadiazol-2-yl)thiophene
- IUPAC
- 2-(5-bromothiophen-2-yl)-5-methyl-3H-1,2,4-oxadiazole
Names & synonyms
SCHEMBL6170280RIWOYRZHDAJAJV-UHFFFAOYSA-N2-bromo-5-(5-methyl-[1,2,4]oxadiazol-2-yl)thiophene
Database identifiers
- PubChem CID
- 69690117
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 212
Related reactions
2 records
Compound notes
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