4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide

C23H20N4O4S — CID 39463274

IUPAC4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2ccc(-n3cccn3)cc2)cc1
InChIInChI=1S/C23H20N4O4S/c1-31-22-6-3-2-5-21(22)26-32(29,30)20-13-7-17(8-14-20)23(28)25-18-9-11-19(12-10-18)27-16-4-15-24-27/h2-16,26H,1H3,(H,25,28)
InChIKeyOEPFUXVABSRYJJ-UHFFFAOYSA-N
MW448.50 g/mol
LogP3.93
Rot. Bonds7

About 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide

4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide (PubChem CID 39463274) has the molecular formula C23H20N4O4S and a molecular weight of 448.50 g/mol. Its IUPAC name is 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide.

Molecular Properties

Compound Name4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide
PubChem CID39463274
Molecular FormulaC23H20N4O4S
Molecular Weight448.50 g/mol
Exact Mass448.12
IUPAC Name4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2ccc(-n3cccn3)cc2)cc1
InChIInChI=1S/C23H20N4O4S/c1-31-22-6-3-2-5-21(22)26-32(29,30)20-13-7-17(8-14-20)23(28)25-18-9-11-19(12-10-18)27-16-4-15-24-27/h2-16,26H,1H3,(H,25,28)
InChIKeyOEPFUXVABSRYJJ-UHFFFAOYSA-N
XLogP3.93
TPSA102.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.50
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 4263456
4-[(2-methoxyphenyl)sulfamoyl]-N-(3-methylphenyl)benzamide
CID 26538003
3-methoxy-N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 2449372
N-[2-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]-4-(5-methylpyrazol-1-yl)benzamide
CID 46683088
methyl N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]carbamate
CID 678083
N-(3,4-diethoxyphenyl)-4-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26878798
4-[(2-methoxyphenyl)sulfamoyl]-N-(1-pyrazol-1-ylpropan-2-yl)benzamide
CID 43064966
4-pyrazol-1-yl-N-[4-(2,2,2-trifluoroethylsulfamoyl)phenyl]benzamide
CID 26425964
N-(2-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7939173
4-[(2-methoxyphenyl)sulfamoyl]-N-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]benzamide
CID 55845079
4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide
CID 31321858
1-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-methylurea
CID 149149080

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide?
The IUPAC name of 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide (CID 39463274) is 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide.
What is the SMILES notation for 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide?
The canonical SMILES for 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide is COc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2ccc(-n3cccn3)cc2)cc1.
What is the InChIKey of 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide?
The InChIKey is OEPFUXVABSRYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O4S/c1-31-22-6-3-2-5-21(22)26-32(29,30)20-13-7-17(8-14-20)23(28)25-18-9-11-19(12-10-18)27-16-4-15-24-27/h2-16,26H,1H3,(H,25,28).
What are the key properties of 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide?
4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide has a molecular weight of 448.50 g/mol, XLogP of 3.93, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenyl)sulfamoyl]-N-(4-pyrazol-1-ylphenyl)benzamide is sourced from PubChem (CID 39463274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).