4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide

C23H19N3O4S — CID 31321858

IUPAC4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2cccc3cccnc23)cc1
InChIInChI=1S/C23H19N3O4S/c1-30-21-10-3-2-8-19(21)26-31(28,29)18-13-11-17(12-14-18)23(27)25-20-9-4-6-16-7-5-15-24-22(16)20/h2-15,26H,1H3,(H,25,27)
InChIKeyKKNQTZOSXODYKJ-UHFFFAOYSA-N
MW433.49 g/mol
LogP4.30
Rot. Bonds6

About 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide

4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide (PubChem CID 31321858) has the molecular formula C23H19N3O4S and a molecular weight of 433.49 g/mol. Its IUPAC name is 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide.

Molecular Properties

Compound Name4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide
PubChem CID31321858
Molecular FormulaC23H19N3O4S
Molecular Weight433.49 g/mol
Exact Mass433.11
IUPAC Name4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2cccc3cccnc23)cc1
InChIInChI=1S/C23H19N3O4S/c1-30-21-10-3-2-8-19(21)26-31(28,29)18-13-11-17(12-14-18)23(27)25-20-9-4-6-16-7-5-15-24-22(16)20/h2-15,26H,1H3,(H,25,27)
InChIKeyKKNQTZOSXODYKJ-UHFFFAOYSA-N
XLogP4.30
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.49
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(tert-butylsulfamoyl)-N-quinolin-8-ylbenzamide
CID 31542150
3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109108883
N-(2-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7939173
N-[2-methoxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]naphthalene-2-carboxamide
CID 24635874
4-[(2-methoxyphenyl)sulfamoyl]-N-(3-methylphenyl)benzamide
CID 26538003
N-(2-methoxyphenyl)-2-(quinolin-8-ylamino)pyrimidine-5-carboxamide
CID 109269429
N-(4-chloro-2-methylphenyl)-4-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26665081
N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 4263456
N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
3-ethoxy-4-methoxy-N-quinolin-8-ylbenzamide
CID 26123353
4-pyrrolidin-1-ylsulfonyl-N-quinolin-8-ylbenzamide
CID 26123612
5-(2-methoxyanilino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109199751

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide?
The IUPAC name of 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide (CID 31321858) is 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide.
What is the SMILES notation for 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide?
The canonical SMILES for 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide is COc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2cccc3cccnc23)cc1.
What is the InChIKey of 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide?
The InChIKey is KKNQTZOSXODYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O4S/c1-30-21-10-3-2-8-19(21)26-31(28,29)18-13-11-17(12-14-18)23(27)25-20-9-4-6-16-7-5-15-24-22(16)20/h2-15,26H,1H3,(H,25,27).
What are the key properties of 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide?
4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide has a molecular weight of 433.49 g/mol, XLogP of 4.30, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide is sourced from PubChem (CID 31321858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).