Basic information
- Standard SMILES
COC(=O)c1c(-c2ccccc2)nn2cc(I)ccc12- InChIKey
SHMLLHIKHGUSSD-UHFFFAOYSA-N- Molecular formula
- C15H11IN2O2
- Average molar mass
- 378.16 g/mol
Names & identifiers
- Preferred name
- Methyl 6-iodo-2-phenylpyrazolo[1,5-a]pyridine-3-carboxylate
- IUPAC
- methyl 6-iodo-2-phenylpyrazolo[1,5-a]pyridine-3-carboxylate
Names & synonyms
SCHEMBL1936384SHMLLHIKHGUSSD-UHFFFAOYSA-Nmethyl 6-iodo-2-phenylpyrazolo[1,5-a]pyridine-3-carboxylateMethyl-6-iodo-2-phenylpyrazolo[1,5-a]pyridine-3-carboxylate
Database identifiers
- PubChem CID
- 59233743
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 360
Related reactions
8 records
Linked notes
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