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Basic information
- Standard SMILES
COc1ccc(I)n2nc(C3(C(=O)O)CC3)nc12- InChIKey
VJWPPKOWUQQHLR-UHFFFAOYSA-N- Molecular formula
- C11H10IN3O3
- Average molar mass
- 359.12 g/mol
- Monoisotopic mass
- 358.97669
Names & identifiers
- Preferred name
- 1-(5-Iodo-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-cyclopropanecarboxylic acid
- IUPAC
- 1-(5-iodo-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropane-1-carboxylic acid
Names & synonyms
SCHEMBL508221VJWPPKOWUQQHLR-UHFFFAOYSA-NDB-1320081-(5-Iodo-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-cyclopropanecarboxylic acid1-(5-Iodo-8-methoxy[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxylic acid1232335-86-2
Database identifiers
- PubChem CID
- 58074591
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 363
Related reactions
2 records
Compound notes
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