3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide

C14H11N7O2S — CID 118266109

IUPAC3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2ccc3nccn3c2)c1-c1nn[nH]n1
InChIInChI=1S/C14H11N7O2S/c15-24(22,23)11-3-1-2-10(13(11)14-17-19-20-18-14)9-4-5-12-16-6-7-21(12)8-9/h1-8H,(H2,15,22,23)(H,17,18,19,20)
InChIKeyFDOCCDDYPQGXLJ-UHFFFAOYSA-N
MW341.36 g/mol
LogP0.83
Rot. Bonds3

About 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide

3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide (PubChem CID 118266109) has the molecular formula C14H11N7O2S and a molecular weight of 341.36 g/mol. Its IUPAC name is 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide
PubChem CID118266109
Molecular FormulaC14H11N7O2S
Molecular Weight341.36 g/mol
Exact Mass341.07
IUPAC Name3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2ccc3nccn3c2)c1-c1nn[nH]n1
InChIInChI=1S/C14H11N7O2S/c15-24(22,23)11-3-1-2-10(13(11)14-17-19-20-18-14)9-4-5-12-16-6-7-21(12)8-9/h1-8H,(H2,15,22,23)(H,17,18,19,20)
InChIKeyFDOCCDDYPQGXLJ-UHFFFAOYSA-N
XLogP0.83
TPSA131.92 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.36
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide?
The IUPAC name of 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide (CID 118266109) is 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide.
What is the SMILES notation for 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide?
The canonical SMILES for 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide is NS(=O)(=O)c1cccc(-c2ccc3nccn3c2)c1-c1nn[nH]n1.
What is the InChIKey of 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide?
The InChIKey is FDOCCDDYPQGXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N7O2S/c15-24(22,23)11-3-1-2-10(13(11)14-17-19-20-18-14)9-4-5-12-16-6-7-21(12)8-9/h1-8H,(H2,15,22,23)(H,17,18,19,20).
What are the key properties of 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide?
3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide has a molecular weight of 341.36 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,2-a]pyridin-6-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 118266109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).