3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine

C24H16FN7O — CID 136946056

IUPAC3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine
SMILESCOc1cc(F)cc(-c2ccnc3nc(-c4[nH]nc5ncc(-c6ccccn6)cc45)[nH]c23)c1
InChIInChI=1S/C24H16FN7O/c1-33-16-9-13(8-15(25)11-16)17-5-7-27-23-20(17)29-24(30-23)21-18-10-14(12-28-22(18)32-31-21)19-4-2-3-6-26-19/h2-12H,1H3,(H,27,29,30)(H,28,31,32)
InChIKeyKTBZIZYTMGCMJC-UHFFFAOYSA-N
MW437.44 g/mol
LogP4.77
Rot. Bonds4

About 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine

3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine (PubChem CID 136946056) has the molecular formula C24H16FN7O and a molecular weight of 437.44 g/mol. Its IUPAC name is 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine
PubChem CID136946056
Molecular FormulaC24H16FN7O
Molecular Weight437.44 g/mol
Exact Mass437.14
IUPAC Name3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine
SMILESCOc1cc(F)cc(-c2ccnc3nc(-c4[nH]nc5ncc(-c6ccccn6)cc45)[nH]c23)c1
InChIInChI=1S/C24H16FN7O/c1-33-16-9-13(8-15(25)11-16)17-5-7-27-23-20(17)29-24(30-23)21-18-10-14(12-28-22(18)32-31-21)19-4-2-3-6-26-19/h2-12H,1H3,(H,27,29,30)(H,28,31,32)
InChIKeyKTBZIZYTMGCMJC-UHFFFAOYSA-N
XLogP4.77
TPSA105.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.44
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine with MolForge

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Related Compounds

5-[3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol
CID 136946057
2-[[5-[3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]oxy]-N,N-dimethylethanamine
CID 136946084
5-[3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-N-(3-methylbutyl)pyridin-3-amine
CID 137286671
2-(dimethylamino)-N-[5-[3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]acetamide
CID 136946060
3-[4-(3-fluoro-5-methoxyphenyl)-1H-pyrrolo[2,3-c]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine
CID 137040687
3-fluoro-5-[2-(5-pyridin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenol
CID 137057177
2-[3-fluoro-5-[2-[5-(4-methyl-3-pyridinyl)-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-imidazo[4,5-b]pyridin-7-yl]phenoxy]-N,N-dimethylethanamine
CID 137057058
3-fluoro-5-[2-(5-pyrimidin-5-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenol
CID 137057162
3-[7-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridine
CID 137057086
5-[3-[7-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-ol
CID 137057138
1-[5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-3-phenylpropan-2-one
CID 158677587
N-[5-[3-[7-(3-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-2-phenylacetamide
CID 137057191

Frequently Asked Questions

What is the IUPAC name of 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine (CID 136946056) is 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine is COc1cc(F)cc(-c2ccnc3nc(-c4[nH]nc5ncc(-c6ccccn6)cc45)[nH]c23)c1.
What is the InChIKey of 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine?
The InChIKey is KTBZIZYTMGCMJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN7O/c1-33-16-9-13(8-15(25)11-16)17-5-7-27-23-20(17)29-24(30-23)21-18-10-14(12-28-22(18)32-31-21)19-4-2-3-6-26-19/h2-12H,1H3,(H,27,29,30)(H,28,31,32).
What are the key properties of 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine?
3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine has a molecular weight of 437.44 g/mol, XLogP of 4.77, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 136946056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).