1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide

C22H18N4O4S — CID 122323269

IUPAC1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide
SMILESCOc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)Cc1noc2ccccc12
InChIInChI=1S/C22H18N4O4S/c1-29-21-10-9-15(18-13-26-11-5-4-8-22(26)23-18)12-17(21)25-31(27,28)14-19-16-6-2-3-7-20(16)30-24-19/h2-13,25H,14H2,1H3
InChIKeyBIYZWRUOQMSGDB-UHFFFAOYSA-N
MW434.48 g/mol
LogP4.09
Rot. Bonds6

About 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide

1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide (PubChem CID 122323269) has the molecular formula C22H18N4O4S and a molecular weight of 434.48 g/mol. Its IUPAC name is 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide.

Molecular Properties

Compound Name1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide
PubChem CID122323269
Molecular FormulaC22H18N4O4S
Molecular Weight434.48 g/mol
Exact Mass434.10
IUPAC Name1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide
SMILESCOc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)Cc1noc2ccccc12
InChIInChI=1S/C22H18N4O4S/c1-29-21-10-9-15(18-13-26-11-5-4-8-22(26)23-18)12-17(21)25-31(27,28)14-19-16-6-2-3-7-20(16)30-24-19/h2-13,25H,14H2,1H3
InChIKeyBIYZWRUOQMSGDB-UHFFFAOYSA-N
XLogP4.09
TPSA98.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.48
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)methanesulfonamide
CID 122283665
1-(1,2-benzoxazol-3-yl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)methanesulfonamide
CID 122283480
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)-1-(4-methylphenyl)methanesulfonamide
CID 122323264
1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide
CID 122323242
1-(1,2-benzoxazol-3-yl)-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanesulfonamide
CID 122283837
1-(1,2-benzoxazol-3-yl)-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanesulfonamide
CID 122284009
4-chloro-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)benzenesulfonamide
CID 122323097
3-chloro-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)-4-methoxybenzenesulfonamide
CID 122323277
1-(1,2-benzoxazol-3-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]methanesulfonamide
CID 90624426
5-[(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)sulfamoyl]-2-methoxybenzamide
CID 122323270
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)ethanesulfonamide
CID 23608319
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)-3,5-dimethoxybenzamide
CID 122323039

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide?
The IUPAC name of 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide (CID 122323269) is 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide.
What is the SMILES notation for 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide?
The canonical SMILES for 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide is COc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)Cc1noc2ccccc12.
What is the InChIKey of 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide?
The InChIKey is BIYZWRUOQMSGDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O4S/c1-29-21-10-9-15(18-13-26-11-5-4-8-22(26)23-18)12-17(21)25-31(27,28)14-19-16-6-2-3-7-20(16)30-24-19/h2-13,25H,14H2,1H3.
What are the key properties of 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide?
1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide has a molecular weight of 434.48 g/mol, XLogP of 4.09, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-benzoxazol-3-yl)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)methanesulfonamide is sourced from PubChem (CID 122323269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).