7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one

C16H8F3N3O — CID 58189295

IUPAC7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
SMILESO=c1c2cnc3cc(F)c(F)cc3c2[nH]n1-c1ccccc1F
InChIInChI=1S/C16H8F3N3O/c17-10-3-1-2-4-14(10)22-16(23)9-7-20-13-6-12(19)11(18)5-8(13)15(9)21-22/h1-7,21H
InChIKeyUEUYQYIQCBUSTI-UHFFFAOYSA-N
MW315.25 g/mol
LogP3.28
Rot. Bonds1

About 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one

7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one (PubChem CID 58189295) has the molecular formula C16H8F3N3O and a molecular weight of 315.25 g/mol. Its IUPAC name is 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one.

Molecular Properties

Compound Name7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
PubChem CID58189295
Molecular FormulaC16H8F3N3O
Molecular Weight315.25 g/mol
Exact Mass315.06
IUPAC Name7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
SMILESO=c1c2cnc3cc(F)c(F)cc3c2[nH]n1-c1ccccc1F
InChIInChI=1S/C16H8F3N3O/c17-10-3-1-2-4-14(10)22-16(23)9-7-20-13-6-12(19)11(18)5-8(13)15(9)21-22/h1-7,21H
InChIKeyUEUYQYIQCBUSTI-UHFFFAOYSA-N
XLogP3.28
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.25
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_65_B(7)', 'substructure': 'N/A'}

Analyze 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one 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

8-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 58189277
9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 10017510
ethane;7-methyl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 54513102
2-(2-chlorophenyl)-6-fluoro-9-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 678872
8-methyl-2-phenyl-7-piperazin-1-yl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 58189291
3-amino-2-(2-fluorophenyl)-1H-pyrazol-5-one
CID 61263646
N-benzyl-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]quinoline-8-carboxamide
CID 53132430
4-amino-5-cyclopropyl-2-(2-fluorophenyl)-1H-pyrazol-3-one
CID 103994907
2-(1,3-benzothiazol-2-yl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 52916658
2-(3-methoxyphenyl)-7-methyl-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one
CID 134508221
8-chloro-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one
CID 10245085
N-(4-fluoro-3-methylphenyl)-2-(4-methylphenyl)-3-oxo-1H-pyrazolo[4,3-c]quinoline-8-carboxamide
CID 53132492

Frequently Asked Questions

What is the IUPAC name of 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?
The IUPAC name of 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one (CID 58189295) is 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one.
What is the SMILES notation for 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?
The canonical SMILES for 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one is O=c1c2cnc3cc(F)c(F)cc3c2[nH]n1-c1ccccc1F.
What is the InChIKey of 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?
The InChIKey is UEUYQYIQCBUSTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H8F3N3O/c17-10-3-1-2-4-14(10)22-16(23)9-7-20-13-6-12(19)11(18)5-8(13)15(9)21-22/h1-7,21H.
What are the key properties of 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?
7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one has a molecular weight of 315.25 g/mol, XLogP of 3.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one is sourced from PubChem (CID 58189295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).