N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide

C26H26N4O4S — CID 39397805

IUPACN-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide
SMILESCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cnn(-c4ccccc4C)c3C)ccc2C)cc1
InChIInChI=1S/C26H26N4O4S/c1-17-7-5-6-8-24(17)30-19(3)23(16-27-30)26(31)28-21-10-9-18(2)25(15-21)35(32,33)29-20-11-13-22(34-4)14-12-20/h5-16,29H,1-4H3,(H,28,31)
InChIKeyZFDPHKSOKHZQCS-UHFFFAOYSA-N
MW490.59 g/mol
LogP4.86
Rot. Bonds7

About N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide

N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide (PubChem CID 39397805) has the molecular formula C26H26N4O4S and a molecular weight of 490.59 g/mol. Its IUPAC name is N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide
PubChem CID39397805
Molecular FormulaC26H26N4O4S
Molecular Weight490.59 g/mol
Exact Mass490.17
IUPAC NameN-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide
SMILESCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cnn(-c4ccccc4C)c3C)ccc2C)cc1
InChIInChI=1S/C26H26N4O4S/c1-17-7-5-6-8-24(17)30-19(3)23(16-27-30)26(31)28-21-10-9-18(2)25(15-21)35(32,33)29-20-11-13-22(34-4)14-12-20/h5-16,29H,1-4H3,(H,28,31)
InChIKeyZFDPHKSOKHZQCS-UHFFFAOYSA-N
XLogP4.86
TPSA102.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.59
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-bromo-3-methylphenyl)-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide
CID 55604592
3-[(4-methoxyphenyl)sulfamoyl]-4-methyl-N-phenylbenzamide
CID 1039728
N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-1-methyl-2-oxoquinoline-4-carboxamide
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6-chloro-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]pyridine-3-carboxamide
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N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-3-methylthiophene-2-carboxamide
CID 35743328
N-(3,4-dimethylphenyl)sulfonyl-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide
CID 52671803
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide
CID 55606320
2-(cyanomethylsulfanyl)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]benzamide
CID 36679992
2-(4-methoxyphenoxy)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]acetamide
CID 26642497
2-chloro-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methylsulfanylbenzamide
CID 26642387
N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-2,4,5-trimethylfuran-3-carboxamide
CID 26720987
3,4-difluoro-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]benzamide
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Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide?
The IUPAC name of N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide (CID 39397805) is N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide.
What is the SMILES notation for N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide?
The canonical SMILES for N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide is COc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cnn(-c4ccccc4C)c3C)ccc2C)cc1.
What is the InChIKey of N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide?
The InChIKey is ZFDPHKSOKHZQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O4S/c1-17-7-5-6-8-24(17)30-19(3)23(16-27-30)26(31)28-21-10-9-18(2)25(15-21)35(32,33)29-20-11-13-22(34-4)14-12-20/h5-16,29H,1-4H3,(H,28,31).
What are the key properties of N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide?
N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide has a molecular weight of 490.59 g/mol, XLogP of 4.86, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide is sourced from PubChem (CID 39397805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).