N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide

C23H18F2N6O4S — CID 155561533

IUPACN-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide
SMILESCCc1nnc(-c2cnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cn23)o1
InChIInChI=1S/C23H18F2N6O4S/c1-3-21-28-29-23(35-21)18-11-26-20-7-4-13(12-31(18)20)14-8-17(22(34-2)27-10-14)30-36(32,33)19-6-5-15(24)9-16(19)25/h4-12,30H,3H2,1-2H3
InChIKeyVAXGPSLDFLGGNF-UHFFFAOYSA-N
MW512.50 g/mol
LogP4.10
Rot. Bonds7

About N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide

N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide (PubChem CID 155561533) has the molecular formula C23H18F2N6O4S and a molecular weight of 512.50 g/mol. Its IUPAC name is N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide.

Molecular Properties

Compound NameN-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide
PubChem CID155561533
Molecular FormulaC23H18F2N6O4S
Molecular Weight512.50 g/mol
Exact Mass512.11
IUPAC NameN-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide
SMILESCCc1nnc(-c2cnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cn23)o1
InChIInChI=1S/C23H18F2N6O4S/c1-3-21-28-29-23(35-21)18-11-26-20-7-4-13(12-31(18)20)14-8-17(22(34-2)27-10-14)30-36(32,33)19-6-5-15(24)9-16(19)25/h4-12,30H,3H2,1-2H3
InChIKeyVAXGPSLDFLGGNF-UHFFFAOYSA-N
XLogP4.10
TPSA124.51 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500512.50
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide 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 N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide?
The IUPAC name of N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide (CID 155561533) is N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide.
What is the SMILES notation for N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide?
The canonical SMILES for N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide is CCc1nnc(-c2cnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cn23)o1.
What is the InChIKey of N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide?
The InChIKey is VAXGPSLDFLGGNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F2N6O4S/c1-3-21-28-29-23(35-21)18-11-26-20-7-4-13(12-31(18)20)14-8-17(22(34-2)27-10-14)30-36(32,33)19-6-5-15(24)9-16(19)25/h4-12,30H,3H2,1-2H3.
What are the key properties of N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide?
N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide has a molecular weight of 512.50 g/mol, XLogP of 4.10, 7 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide is sourced from PubChem (CID 155561533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).