4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide

C21H20N2O3S — CID 1226832

IUPAC4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(S(=O)(=O)N(C)c3ccccc3)cc2)cc1
InChIInChI=1S/C21H20N2O3S/c1-16-8-10-17(11-9-16)21(24)22-18-12-14-20(15-13-18)27(25,26)23(2)19-6-4-3-5-7-19/h3-15H,1-2H3,(H,22,24)
InChIKeyNNUSYJSCRVNNLS-UHFFFAOYSA-N
MW380.47 g/mol
LogP4.07
Rot. Bonds5

About 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide

4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide (PubChem CID 1226832) has the molecular formula C21H20N2O3S and a molecular weight of 380.47 g/mol. Its IUPAC name is 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide
PubChem CID1226832
Molecular FormulaC21H20N2O3S
Molecular Weight380.47 g/mol
Exact Mass380.12
IUPAC Name4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(S(=O)(=O)N(C)c3ccccc3)cc2)cc1
InChIInChI=1S/C21H20N2O3S/c1-16-8-10-17(11-9-16)21(24)22-18-12-14-20(15-13-18)27(25,26)23(2)19-6-4-3-5-7-19/h3-15H,1-2H3,(H,22,24)
InChIKeyNNUSYJSCRVNNLS-UHFFFAOYSA-N
XLogP4.07
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.47
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 2597397
N-(4-iodophenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 2710071
N-(4-cyanophenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 71904017
N,N-diethyl-4-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]benzamide
CID 26899681
N-[4-(cyclopropylcarbamoylamino)phenyl]-4-[methyl(phenyl)sulfamoyl]benzamide
CID 46533296
N-(3-hydroxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 78783187
N-(3,4-difluorophenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 1294762
N-(2-acetylphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 26067652
N-[4-(cyclopropylcarbamoylamino)phenyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 55532553
4-[methyl(phenyl)sulfamoyl]-N-(4-piperidin-1-ylsulfonylphenyl)benzamide
CID 4849780
N-[(4-methylphenyl)methyl]-4-[methyl(phenyl)sulfamoyl]benzamide
CID 4801142
4-[benzenesulfonyl(methyl)amino]-N-[4-[(3-methylphenyl)sulfamoyl]phenyl]benzamide
CID 43879853

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide?
The IUPAC name of 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide (CID 1226832) is 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide.
What is the SMILES notation for 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide?
The canonical SMILES for 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide is Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)N(C)c3ccccc3)cc2)cc1.
What is the InChIKey of 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide?
The InChIKey is NNUSYJSCRVNNLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3S/c1-16-8-10-17(11-9-16)21(24)22-18-12-14-20(15-13-18)27(25,26)23(2)19-6-4-3-5-7-19/h3-15H,1-2H3,(H,22,24).
What are the key properties of 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide?
4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide has a molecular weight of 380.47 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 1226832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).