4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide

C21H19N3O3S — CID 25038955

IUPAC4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2c(-c3ccccc3)nc3cc(C)ccn23)cc1
InChIInChI=1S/C21H19N3O3S/c1-15-12-13-24-19(14-15)22-20(16-6-4-3-5-7-16)21(24)23-28(25,26)18-10-8-17(27-2)9-11-18/h3-14,23H,1-2H3
InChIKeyKAAZVQZEOIYNHN-UHFFFAOYSA-N
MW393.47 g/mol
LogP4.12
Rot. Bonds5

About 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide

4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide (PubChem CID 25038955) has the molecular formula C21H19N3O3S and a molecular weight of 393.47 g/mol. Its IUPAC name is 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide
PubChem CID25038955
Molecular FormulaC21H19N3O3S
Molecular Weight393.47 g/mol
Exact Mass393.11
IUPAC Name4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2c(-c3ccccc3)nc3cc(C)ccn23)cc1
InChIInChI=1S/C21H19N3O3S/c1-15-12-13-24-19(14-15)22-20(16-6-4-3-5-7-16)21(24)23-28(25,26)18-10-8-17(27-2)9-11-18/h3-14,23H,1-2H3
InChIKeyKAAZVQZEOIYNHN-UHFFFAOYSA-N
XLogP4.12
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.47
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide?
The IUPAC name of 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide (CID 25038955) is 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2c(-c3ccccc3)nc3cc(C)ccn23)cc1.
What is the InChIKey of 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide?
The InChIKey is KAAZVQZEOIYNHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3S/c1-15-12-13-24-19(14-15)22-20(16-6-4-3-5-7-16)21(24)23-28(25,26)18-10-8-17(27-2)9-11-18/h3-14,23H,1-2H3.
What are the key properties of 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide?
4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide has a molecular weight of 393.47 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide is sourced from PubChem (CID 25038955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).