5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one

C15H11FN4O4S — CID 168900413

IUPAC5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
SMILESO=C1CN(c2c(O)ccc(-c3cnn4ccccc34)c2F)S(=O)(=O)N1
InChIInChI=1S/C15H11FN4O4S/c16-14-9(10-7-17-19-6-2-1-3-11(10)19)4-5-12(21)15(14)20-8-13(22)18-25(20,23)24/h1-7,21H,8H2,(H,18,22)
InChIKeyDSJYVBQPCVIVEW-UHFFFAOYSA-N
MW362.34 g/mol
LogP1.03
Rot. Bonds2

About 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one

5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one (PubChem CID 168900413) has the molecular formula C15H11FN4O4S and a molecular weight of 362.34 g/mol. Its IUPAC name is 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one.

Molecular Properties

Compound Name5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
PubChem CID168900413
Molecular FormulaC15H11FN4O4S
Molecular Weight362.34 g/mol
Exact Mass362.05
IUPAC Name5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
SMILESO=C1CN(c2c(O)ccc(-c3cnn4ccccc34)c2F)S(=O)(=O)N1
InChIInChI=1S/C15H11FN4O4S/c16-14-9(10-7-17-19-6-2-1-3-11(10)19)4-5-12(21)15(14)20-8-13(22)18-25(20,23)24/h1-7,21H,8H2,(H,18,22)
InChIKeyDSJYVBQPCVIVEW-UHFFFAOYSA-N
XLogP1.03
TPSA104.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.34
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-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

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one?
The IUPAC name of 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one (CID 168900413) is 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one.
What is the SMILES notation for 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one?
The canonical SMILES for 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one is O=C1CN(c2c(O)ccc(-c3cnn4ccccc34)c2F)S(=O)(=O)N1.
What is the InChIKey of 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one?
The InChIKey is DSJYVBQPCVIVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4O4S/c16-14-9(10-7-17-19-6-2-1-3-11(10)19)4-5-12(21)15(14)20-8-13(22)18-25(20,23)24/h1-7,21H,8H2,(H,18,22).
What are the key properties of 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one?
5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one has a molecular weight of 362.34 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-6-hydroxy-3-pyrazolo[1,5-a]pyridin-3-ylphenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one is sourced from PubChem (CID 168900413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).