6-Iodo-2-methyl[1,2,4]triazolo[4,3-alpha]pyridin-3(2H)-one
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Basic information
- Standard SMILES
Cn1nc2ccc(I)cn2c1=O- InChIKey
UXHLYQRTOKTODL-UHFFFAOYSA-N- Molecular formula
- C7H6IN3O
- Average molar mass
- 275.05 g/mol
Names & identifiers
- Preferred name
- 6-Iodo-2-methyl[1,2,4]triazolo[4,3-alpha]pyridin-3(2H)-one
- IUPAC
- 6-iodo-2-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-one
Names & synonyms
SCHEMBL5249990UXHLYQRTOKTODL-UHFFFAOYSA-N6-Iodo-2-methyl[1,2,4]triazolo[4,3-alpha]pyridin-3(2H)-one
Database identifiers
- PubChem CID
- 58779350
Properties
Computed structural propertiesFilling in
- XLogP
- 0.4
- Topological polar surface area
- 35.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 332
Related reactions
1 records
Compound notes
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