Imidazo[1,5-a]pyridine-3-propanoic acid, 1-chloro-8-fluoro-
Basic information
- CAS
1780183-59-6- Standard SMILES
O=C(O)CCc1nc(Cl)c2c(F)cccn12- InChIKey
LKANAOZITXBPJI-UHFFFAOYSA-N- Molecular formula
- C10H8ClFN2O2
- Average molar mass
- 242.63 g/mol
- Monoisotopic mass
- 242.0258334
Names & identifiers
- Preferred name
- Imidazo[1,5-a]pyridine-3-propanoic acid, 1-chloro-8-fluoro-
- IUPAC
- 3-(1-chloro-8-fluoroimidazo[1,5-a]pyridin-3-yl)propanoic acid
Names & synonyms
DTXSID001187479Imidazo[1,5-a]pyridine-3-propanoic acid, 1-chloro-8-fluoro-3-(1-Chloro-8-fluoroimidazo[1,5-a]pyridin-3-yl)propanoic acid1780183-59-6
Database identifiers
- CAS
1780183-59-6- PubChem CID
- 83899345
- DTXSID
DTXSID001187479
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 280
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Compound notes
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