N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide

C22H21N3O3S — CID 122283297

IUPACN-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2cccc(-c3cn4ccccc4n3)c2)c(C)c1C
InChIInChI=1S/C22H21N3O3S/c1-15-16(2)21(11-10-20(15)28-3)29(26,27)24-18-8-6-7-17(13-18)19-14-25-12-5-4-9-22(25)23-19/h4-14,24H,1-3H3
InChIKeyMTVVPRRLXAHXBP-UHFFFAOYSA-N
MW407.50 g/mol
LogP4.43
Rot. Bonds5

About N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide

N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide (PubChem CID 122283297) has the molecular formula C22H21N3O3S and a molecular weight of 407.50 g/mol. Its IUPAC name is N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide.

Molecular Properties

Compound NameN-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide
PubChem CID122283297
Molecular FormulaC22H21N3O3S
Molecular Weight407.50 g/mol
Exact Mass407.13
IUPAC NameN-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2cccc(-c3cn4ccccc4n3)c2)c(C)c1C
InChIInChI=1S/C22H21N3O3S/c1-15-16(2)21(11-10-20(15)28-3)29(26,27)24-18-8-6-7-17(13-18)19-14-25-12-5-4-9-22(25)23-19/h4-14,24H,1-3H3
InChIKeyMTVVPRRLXAHXBP-UHFFFAOYSA-N
XLogP4.43
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.50
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-diethoxy-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)benzenesulfonamide
CID 122283503
N-[4-[(3-imidazo[1,2-a]pyridin-2-ylphenyl)sulfamoyl]-3-methylphenyl]acetamide
CID 122283470
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,5-dimethoxybenzenesulfonamide
CID 7421295
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)thiophene-2-sulfonamide
CID 122283303
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)quinoline-8-sulfonamide
CID 122283305
3,4-dimethoxy-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 6494028
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-3-methylbenzenesulfonamide
CID 16717662
2-methoxy-5-methyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 122284192
3,4-dichloro-2-methoxy-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 983383
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3,4-dimethoxybenzenesulfonamide
CID 6494027
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-1H-imidazole-5-sulfonamide
CID 122283460
1-(2,3-dimethoxyphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
CID 122283501

Frequently Asked Questions

What is the IUPAC name of N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide?
The IUPAC name of N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide (CID 122283297) is N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide.
What is the SMILES notation for N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide?
The canonical SMILES for N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2cccc(-c3cn4ccccc4n3)c2)c(C)c1C.
What is the InChIKey of N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide?
The InChIKey is MTVVPRRLXAHXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3S/c1-15-16(2)21(11-10-20(15)28-3)29(26,27)24-18-8-6-7-17(13-18)19-14-25-12-5-4-9-22(25)23-19/h4-14,24H,1-3H3.
What are the key properties of N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide?
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide has a molecular weight of 407.50 g/mol, XLogP of 4.43, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2,3-dimethylbenzenesulfonamide is sourced from PubChem (CID 122283297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).