4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide

C22H19ClN4O4S — CID 56928452

IUPAC4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide
SMILESCOc1ccc(Cl)cc1NS(=O)(=O)c1ccc(C(=O)NCc2ccc3nccn3c2)cc1
InChIInChI=1S/C22H19ClN4O4S/c1-31-20-8-5-17(23)12-19(20)26-32(29,30)18-6-3-16(4-7-18)22(28)25-13-15-2-9-21-24-10-11-27(21)14-15/h2-12,14,26H,13H2,1H3,(H,25,28)
InChIKeyJVUJBPNHODGVGM-UHFFFAOYSA-N
MW470.94 g/mol
LogP3.73
Rot. Bonds7

About 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide

4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide (PubChem CID 56928452) has the molecular formula C22H19ClN4O4S and a molecular weight of 470.94 g/mol. Its IUPAC name is 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide.

Molecular Properties

Compound Name4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide
PubChem CID56928452
Molecular FormulaC22H19ClN4O4S
Molecular Weight470.94 g/mol
Exact Mass470.08
IUPAC Name4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide
SMILESCOc1ccc(Cl)cc1NS(=O)(=O)c1ccc(C(=O)NCc2ccc3nccn3c2)cc1
InChIInChI=1S/C22H19ClN4O4S/c1-31-20-8-5-17(23)12-19(20)26-32(29,30)18-6-3-16(4-7-18)22(28)25-13-15-2-9-21-24-10-11-27(21)14-15/h2-12,14,26H,13H2,1H3,(H,25,28)
InChIKeyJVUJBPNHODGVGM-UHFFFAOYSA-N
XLogP3.73
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.94
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(3-chlorophenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide
CID 56928346
N-[[4-(5-acetyl-2-methoxyphenyl)sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 87074884
4-(benzenesulfonyl)-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide
CID 66614342
N-[[4-(4-chloro-2-methoxyphenyl)sulfonylphenyl]methyl]imidazo[1,2-a]pyrazine-6-carboxamide
CID 146220988
3-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(pyridin-2-ylmethyl)benzamide
CID 43002443
N-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 70727068
N-[[4-(2-chlorophenyl)sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 90012691
4-N-(imidazo[1,2-a]pyridin-6-ylmethyl)-1-N-(3-methylbutyl)benzene-1,4-dicarboxamide
CID 72699526
N-[[4-[1-(3-chlorophenyl)pyrazol-4-yl]sulfonylphenyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 90012461
N-[[4-(4-fluoro-3-methoxyphenyl)sulfonylphenyl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide
CID 66613617
N-[2-(4-chlorophenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 110703993
N-[[3-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methyl]-4-(methoxysulfamoyl)benzamide
CID 55843428

Frequently Asked Questions

What is the IUPAC name of 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide?
The IUPAC name of 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide (CID 56928452) is 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide.
What is the SMILES notation for 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide?
The canonical SMILES for 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide is COc1ccc(Cl)cc1NS(=O)(=O)c1ccc(C(=O)NCc2ccc3nccn3c2)cc1.
What is the InChIKey of 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide?
The InChIKey is JVUJBPNHODGVGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClN4O4S/c1-31-20-8-5-17(23)12-19(20)26-32(29,30)18-6-3-16(4-7-18)22(28)25-13-15-2-9-21-24-10-11-27(21)14-15/h2-12,14,26H,13H2,1H3,(H,25,28).
What are the key properties of 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide?
4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide has a molecular weight of 470.94 g/mol, XLogP of 3.73, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(imidazo[1,2-a]pyridin-6-ylmethyl)benzamide is sourced from PubChem (CID 56928452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).