5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine

C22H14N4O — CID 135525264

IUPAC5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine
SMILESc1c[nH]c(-c2[nH]nc3ncc(-c4cccc5c4oc4ccccc45)cc23)c1
InChIInChI=1S/C22H14N4O/c1-2-9-19-15(5-1)16-7-3-6-14(21(16)27-19)13-11-17-20(18-8-4-10-23-18)25-26-22(17)24-12-13/h1-12,23H,(H,24,25,26)
InChIKeyNSWBCROVFXVZNX-UHFFFAOYSA-N
MW350.38 g/mol
LogP5.52
Rot. Bonds2

About 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine

5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine (PubChem CID 135525264) has the molecular formula C22H14N4O and a molecular weight of 350.38 g/mol. Its IUPAC name is 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine
PubChem CID135525264
Molecular FormulaC22H14N4O
Molecular Weight350.38 g/mol
Exact Mass350.12
IUPAC Name5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine
SMILESc1c[nH]c(-c2[nH]nc3ncc(-c4cccc5c4oc4ccccc45)cc23)c1
InChIInChI=1S/C22H14N4O/c1-2-9-19-15(5-1)16-7-3-6-14(21(16)27-19)13-11-17-20(18-8-4-10-23-18)25-26-22(17)24-12-13/h1-12,23H,(H,24,25,26)
InChIKeyNSWBCROVFXVZNX-UHFFFAOYSA-N
XLogP5.52
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.38
LogP ≤ 55.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-dibenzofuran-4-yl-8,16-dioxa-5-azatetracyclo[7.7.0.02,7.010,15]hexadeca-1(9),2,4,6,10,12,14-heptaene
CID 162500362
2-dibenzofuran-4-yl-5-(4-fluorophenyl)pyridine
CID 166564112
2-dibenzofuran-4-yl-5-[3-(2-dibenzofuran-4-ylpyrimidin-5-yl)naphthalen-2-yl]pyrimidine
CID 118477908
2-dibenzofuran-4-ylpyridine
CID 59500175
2-dibenzofuran-4-yl-5-naphthalen-2-ylpyridine
CID 171576906
3-[3-[4-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-7,10-diphenylphenanthro[9,10-b]pyrazine
CID 129063498
3-(3-dibenzofuran-4-ylphenyl)-7,10-diphenylphenanthro[9,10-b]pyrazine
CID 58410421
3-[3-[3-[4-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063454
3-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063395
3-[3-[4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063457
2-dibenzofuran-4-yl-1H-imidazole
CID 123662099
2,8-bis(4-dibenzofuran-4-ylphenyl)-[1]benzofuro[2,3-b]pyrazine
CID 146600450

Frequently Asked Questions

What is the IUPAC name of 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine (CID 135525264) is 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine is c1c[nH]c(-c2[nH]nc3ncc(-c4cccc5c4oc4ccccc45)cc23)c1.
What is the InChIKey of 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine?
The InChIKey is NSWBCROVFXVZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14N4O/c1-2-9-19-15(5-1)16-7-3-6-14(21(16)27-19)13-11-17-20(18-8-4-10-23-18)25-26-22(17)24-12-13/h1-12,23H,(H,24,25,26).
What are the key properties of 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine?
5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine has a molecular weight of 350.38 g/mol, XLogP of 5.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-dibenzofuran-4-yl-3-(1H-pyrrol-2-yl)-2H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 135525264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).