1H-Pyrazolo[3,4-b]pyridine-3-carboximidamide, 5-fluoro-1-[(2-fluorophenyl)methyl]-, hydrochloride (1:1)
Basic information
- CAS
1426309-48-9- Standard SMILES
Cl.N=C(N)c1nn(Cc2ccccc2F)c2ncc(F)cc12- InChIKey
SAYWMFNKUAMSSN-UHFFFAOYSA-N- Molecular formula
- C14H12ClF2N5
- Average molar mass
- 323.73 g/mol
- Monoisotopic mass
- 323.0749294
Overview
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Names & identifiers
- Preferred name
- 1H-Pyrazolo[3,4-b]pyridine-3-carboximidamide, 5-fluoro-1-[(2-fluorophenyl)methyl]-, hydrochloride (1:1)
- IUPAC
- 5-fluoro-1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboximidamide;hydrochloride
- English name
- 1H-Pyrazolo[3,4-b]pyridine-3-carboximidamide, 5-fluoro-1-[(2-fluorophenyl)methyl]-, hydrochloride (1:1)
- Molecular formula
- C14H12ClF2N5
- Molecular weight
- 323.73
Names & synonyms
1H-Pyrazolo[3,4-b]pyridine-3-carboximidamide, 5-fluoro-1-[(2-fluorophenyl)methyl]-, hydrochloride (1:1)1H-Pyrazolo(3,4-b)pyridine-3-carboximidamide, 5-fluoro-1-((2-fluorophenyl)methyl)-, hydrochloride (1:1)RefChem:4391251426309-48-95-Fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidamide hydrochloride8R6BM4GLX4SCHEMBL14990786SAYWMFNKUAMSSN-UHFFFAOYSA-NVericiguat Impurity 57 hydrochlorideSB163535-fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridine-3-carboximidamide hydrochlorideVericiguat Impurity 9 HCl
Show more names
Vericiguat Impurity 16 HClVericiguat Carboxidamide Hydrochloride Impurity1H-Pyrazolo[3,4-b]pyridine-3-carboximidamide, 5-fluoro-1-[(2-fluorophenyl)methyl]-, hydrochloride
Properties
Computed structural properties
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 394
Physicochemical properties
- InChI
- InChI=1S/C14H11F2N5.ClH/c15-9-5-10-12(13(17)18)20-21(14(10)19-6-9)7-8-3-1-2-4-11(8)16;/h1-6H,7H2,(H3,17,18);1H
- InChIKey
- SAYWMFNKUAMSSN-UHFFFAOYSA-N
- SMILES
- C(C1C=CC=CC=1F)N1N=C(C(N)=N)C2=CC(F)=CN=C12.Cl
- REACH Registrations
- Active
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- REACH Registrations
- Active
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Related reactions
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Compound notes
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