3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide

C24H21N3O4S — CID 55376485

IUPAC3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(C(=O)Nc2ccc3ccccc3n2)ccc1C
InChIInChI=1S/C24H21N3O4S/c1-16-11-12-18(24(28)26-23-14-13-17-7-3-4-8-19(17)25-23)15-22(16)32(29,30)27-20-9-5-6-10-21(20)31-2/h3-15,27H,1-2H3,(H,25,26,28)
InChIKeyOAHOIHBJWROHOS-UHFFFAOYSA-N
MW447.52 g/mol
LogP4.60
Rot. Bonds6

About 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide

3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide (PubChem CID 55376485) has the molecular formula C24H21N3O4S and a molecular weight of 447.52 g/mol. Its IUPAC name is 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide.

Molecular Properties

Compound Name3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide
PubChem CID55376485
Molecular FormulaC24H21N3O4S
Molecular Weight447.52 g/mol
Exact Mass447.13
IUPAC Name3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(C(=O)Nc2ccc3ccccc3n2)ccc1C
InChIInChI=1S/C24H21N3O4S/c1-16-11-12-18(24(28)26-23-14-13-17-7-3-4-8-19(17)25-23)15-22(16)32(29,30)27-20-9-5-6-10-21(20)31-2/h3-15,27H,1-2H3,(H,25,26,28)
InChIKeyOAHOIHBJWROHOS-UHFFFAOYSA-N
XLogP4.60
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.52
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dimethylphenyl)-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 2687808
N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 7908217
3-[[3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzoyl]amino]benzoic acid
CID 1081903
N-(5-chloro-2-hydroxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 56581281
3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-(2-methyl-4-propan-2-yloxyphenyl)benzamide
CID 55945307
N-[3-[(2-methoxyphenyl)sulfamoyl]-4-methylphenyl]-4-methylbenzamide
CID 71904027
N-[6-(dimethylamino)-3-pyridinyl]-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 30295673
N-(3,4-diethoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 26878789
4-chloro-N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 46525468
N-(1-adamantyl)-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 3257461
3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-[3-oxo-3-(propylamino)propyl]benzamide
CID 55954729
N-[(2-chlorophenyl)methyl]-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 2612888

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide?
The IUPAC name of 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide (CID 55376485) is 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide.
What is the SMILES notation for 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide?
The canonical SMILES for 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide is COc1ccccc1NS(=O)(=O)c1cc(C(=O)Nc2ccc3ccccc3n2)ccc1C.
What is the InChIKey of 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide?
The InChIKey is OAHOIHBJWROHOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O4S/c1-16-11-12-18(24(28)26-23-14-13-17-7-3-4-8-19(17)25-23)15-22(16)32(29,30)27-20-9-5-6-10-21(20)31-2/h3-15,27H,1-2H3,(H,25,26,28).
What are the key properties of 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide?
3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide has a molecular weight of 447.52 g/mol, XLogP of 4.60, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxyphenyl)sulfamoyl]-4-methyl-N-quinolin-2-ylbenzamide is sourced from PubChem (CID 55376485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).