N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide

C23H21N3O4S — CID 122323542

IUPACN-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide
SMILESCOc1ccc(-c2cn3cccc(C)c3n2)cc1NS(=O)(=O)c1ccc2c(c1)CCO2
InChIInChI=1S/C23H21N3O4S/c1-15-4-3-10-26-14-20(24-23(15)26)16-5-7-22(29-2)19(13-16)25-31(27,28)18-6-8-21-17(12-18)9-11-30-21/h3-8,10,12-14,25H,9,11H2,1-2H3
InChIKeyGTQBFQVJXVMYJG-UHFFFAOYSA-N
MW435.51 g/mol
LogP4.05
Rot. Bonds5

About N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide

N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide (PubChem CID 122323542) has the molecular formula C23H21N3O4S and a molecular weight of 435.51 g/mol. Its IUPAC name is N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide.

Molecular Properties

Compound NameN-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide
PubChem CID122323542
Molecular FormulaC23H21N3O4S
Molecular Weight435.51 g/mol
Exact Mass435.13
IUPAC NameN-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide
SMILESCOc1ccc(-c2cn3cccc(C)c3n2)cc1NS(=O)(=O)c1ccc2c(c1)CCO2
InChIInChI=1S/C23H21N3O4S/c1-15-4-3-10-26-14-20(24-23(15)26)16-5-7-22(29-2)19(13-16)25-31(27,28)18-6-8-21-17(12-18)9-11-30-21/h3-8,10,12-14,25H,9,11H2,1-2H3
InChIKeyGTQBFQVJXVMYJG-UHFFFAOYSA-N
XLogP4.05
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.51
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonamide
CID 122323556
4-acetyl-N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 122323524
N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-nitrobenzenesulfonamide
CID 122323583
4-butoxy-N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 122323379
N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 121149747
N-[2-methoxy-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
CID 122322978
N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide
CID 55362628
4-ethoxy-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 23608343
N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
CID 122323301
3-chloro-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)-4-methoxybenzenesulfonamide
CID 122323277
N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-methylbenzamide
CID 122323314
5-[(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)sulfamoyl]-2-methoxybenzamide
CID 122323270

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide?
The IUPAC name of N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide (CID 122323542) is N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide.
What is the SMILES notation for N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide?
The canonical SMILES for N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide is COc1ccc(-c2cn3cccc(C)c3n2)cc1NS(=O)(=O)c1ccc2c(c1)CCO2.
What is the InChIKey of N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide?
The InChIKey is GTQBFQVJXVMYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O4S/c1-15-4-3-10-26-14-20(24-23(15)26)16-5-7-22(29-2)19(13-16)25-31(27,28)18-6-8-21-17(12-18)9-11-30-21/h3-8,10,12-14,25H,9,11H2,1-2H3.
What are the key properties of N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide?
N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide has a molecular weight of 435.51 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2,3-dihydro-1-benzofuran-5-sulfonamide is sourced from PubChem (CID 122323542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).