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

C24H20F2N6O5S — CID 155534162

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

2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide (PubChem CID 155534162) has the molecular formula C24H20F2N6O5S and a molecular weight of 542.52 g/mol. Its IUPAC name is 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide.

Molecular Properties

• Compound Name: 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide
• PubChem CID: 155534162
• Molecular Formula: C24H20F2N6O5S
• Molecular Weight: 542.52 g/mol
• Exact Mass: 542.12
• IUPAC Name: 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide
• SMILES: COCCc1nnc(-c2cnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cn23)o1
• InChI: InChI=1S/C24H20F2N6O5S/c1-35-8-7-22-29-30-24(37-22)19-12-27-21-6-3-14(13-32(19)21)15-9-18(23(36-2)28-11-15)31-38(33,34)20-5-4-16(25)10-17(20)26/h3-6,9-13,31H,7-8H2,1-2H3
• InChIKey: VTZLOABVMWXLPA-UHFFFAOYSA-N
• XLogP: 3.72
• TPSA: 133.74 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 10
• Rotatable Bonds: 9
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	542.52
LogP ≤ 5	3.72
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide?

The IUPAC name of 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide (CID 155534162) is 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide.

What is the SMILES notation for 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide?

The canonical SMILES for 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide is COCCc1nnc(-c2cnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cn23)o1.

What is the InChIKey of 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide?

The InChIKey is VTZLOABVMWXLPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F2N6O5S/c1-35-8-7-22-29-30-24(37-22)19-12-27-21-6-3-14(13-32(19)21)15-9-18(23(36-2)28-11-15)31-38(33,34)20-5-4-16(25)10-17(20)26/h3-6,9-13,31H,7-8H2,1-2H3.

What are the key properties of 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide?

2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide has a molecular weight of 542.52 g/mol, XLogP of 3.72, 9 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-difluoro-N-[2-methoxy-5-[3-[5-(2-methoxyethyl)-1,3,4-oxadiazol-2-yl]imidazo[1,2-a]pyridin-6-yl]-3-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 155534162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).