4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine

C18H10ClF2N3O — CID 141123072

IUPAC4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine
SMILESFc1ccc(Oc2cc(-c3ccccc3Cl)c3cn[nH]c3n2)c(F)c1
InChIInChI=1S/C18H10ClF2N3O/c19-14-4-2-1-3-11(14)12-8-17(23-18-13(12)9-22-24-18)25-16-6-5-10(20)7-15(16)21/h1-9H,(H,22,23,24)
InChIKeyWPGPEKIOPVMHRP-UHFFFAOYSA-N
MW357.75 g/mol
LogP5.35
Rot. Bonds3

About 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine

4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine (PubChem CID 141123072) has the molecular formula C18H10ClF2N3O and a molecular weight of 357.75 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine
PubChem CID141123072
Molecular FormulaC18H10ClF2N3O
Molecular Weight357.75 g/mol
Exact Mass357.05
IUPAC Name4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine
SMILESFc1ccc(Oc2cc(-c3ccccc3Cl)c3cn[nH]c3n2)c(F)c1
InChIInChI=1S/C18H10ClF2N3O/c19-14-4-2-1-3-11(14)12-8-17(23-18-13(12)9-22-24-18)25-16-6-5-10(20)7-15(16)21/h1-9H,(H,22,23,24)
InChIKeyWPGPEKIOPVMHRP-UHFFFAOYSA-N
XLogP5.35
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.75
LogP ≤ 55.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-3-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-2H-pyrazolo[3,4-b]pyrazine
CID 59812813
3-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-4-ethoxy-2H-pyrazolo[3,4-d]pyrimidine
CID 59813002
6-(2,4-difluorophenoxy)-3-(2-ethoxyphenyl)-2H-pyrazolo[3,4-b]pyridine
CID 59834415
N-[3-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N',N'-dimethylpropane-1,3-diamine
CID 59812835
6-[[3-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]amino]hexane-1,2,3,4,5-pentol
CID 69212680
(2S,3R)-2-[[3-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]amino]-3-hydroxybutanoic acid
CID 59812885
4-(2-chloro-4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CID 56706662
2-(2,4-difluorophenoxy)-4,8-dimethylquinoline
CID 3838364
2-(2-chloro-6-fluorophenyl)-N-[6-(2,4-difluorophenoxy)-3-pyridinyl]acetamide
CID 154872994
5-chloro-2-(2-chloro-4-fluorophenoxy)pyridine
CID 66234554
3-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-4-propoxy-1H-indazole
CID 91541039
2-chloro-6-(2,4-difluorophenoxy)pyrido[3,4-d]pyrimidine
CID 11460591

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine?
The IUPAC name of 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine (CID 141123072) is 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine.
What is the SMILES notation for 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine?
The canonical SMILES for 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine is Fc1ccc(Oc2cc(-c3ccccc3Cl)c3cn[nH]c3n2)c(F)c1.
What is the InChIKey of 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine?
The InChIKey is WPGPEKIOPVMHRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10ClF2N3O/c19-14-4-2-1-3-11(14)12-8-17(23-18-13(12)9-22-24-18)25-16-6-5-10(20)7-15(16)21/h1-9H,(H,22,23,24).
What are the key properties of 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine?
4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine has a molecular weight of 357.75 g/mol, XLogP of 5.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-6-(2,4-difluorophenoxy)-1H-pyrazolo[5,4-b]pyridine is sourced from PubChem (CID 141123072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).