4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide

C20H15F2N3O3S — CID 139886815

IUPAC4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2c(-c3ccc(OC(F)F)cc3)nn3ccccc23)cc1
InChIInChI=1S/C20H15F2N3O3S/c21-20(22)28-15-8-4-14(5-9-15)19-18(17-3-1-2-12-25(17)24-19)13-6-10-16(11-7-13)29(23,26)27/h1-12,20H,(H2,23,26,27)
InChIKeyKTBCZBQGXPDAAD-UHFFFAOYSA-N
MW415.42 g/mol
LogP3.92
Rot. Bonds5

About 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide

4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide (PubChem CID 139886815) has the molecular formula C20H15F2N3O3S and a molecular weight of 415.42 g/mol. Its IUPAC name is 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide.

Molecular Properties

Compound Name4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide
PubChem CID139886815
Molecular FormulaC20H15F2N3O3S
Molecular Weight415.42 g/mol
Exact Mass415.08
IUPAC Name4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2c(-c3ccc(OC(F)F)cc3)nn3ccccc23)cc1
InChIInChI=1S/C20H15F2N3O3S/c21-20(22)28-15-8-4-14(5-9-15)19-18(17-3-1-2-12-25(17)24-19)13-6-10-16(11-7-13)29(23,26)27/h1-12,20H,(H2,23,26,27)
InChIKeyKTBCZBQGXPDAAD-UHFFFAOYSA-N
XLogP3.92
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.42
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide 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 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide?
The IUPAC name of 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide (CID 139886815) is 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide.
What is the SMILES notation for 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide?
The canonical SMILES for 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide is NS(=O)(=O)c1ccc(-c2c(-c3ccc(OC(F)F)cc3)nn3ccccc23)cc1.
What is the InChIKey of 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide?
The InChIKey is KTBCZBQGXPDAAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N3O3S/c21-20(22)28-15-8-4-14(5-9-15)19-18(17-3-1-2-12-25(17)24-19)13-6-10-16(11-7-13)29(23,26)27/h1-12,20H,(H2,23,26,27).
What are the key properties of 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide?
4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide has a molecular weight of 415.42 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyridin-3-yl]benzenesulfonamide is sourced from PubChem (CID 139886815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).