2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide

C23H23N3O5S — CID 71903202

IUPAC2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)Nc2ccc(C)cc2)cc1NC(C)=O
InChIInChI=1S/C23H23N3O5S/c1-15-8-10-17(11-9-15)25-23(28)19-6-4-5-7-20(19)26-32(29,30)18-12-13-22(31-3)21(14-18)24-16(2)27/h4-14,26H,1-3H3,(H,24,27)(H,25,28)
InChIKeyXUPROSVQESXMFD-UHFFFAOYSA-N
MW453.52 g/mol
LogP4.02
Rot. Bonds7

About 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide

2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide (PubChem CID 71903202) has the molecular formula C23H23N3O5S and a molecular weight of 453.52 g/mol. Its IUPAC name is 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound Name2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
PubChem CID71903202
Molecular FormulaC23H23N3O5S
Molecular Weight453.52 g/mol
Exact Mass453.14
IUPAC Name2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)Nc2ccc(C)cc2)cc1NC(C)=O
InChIInChI=1S/C23H23N3O5S/c1-15-8-10-17(11-9-15)25-23(28)19-6-4-5-7-20(19)26-32(29,30)18-12-13-22(31-3)21(14-18)24-16(2)27/h4-14,26H,1-3H3,(H,24,27)(H,25,28)
InChIKeyXUPROSVQESXMFD-UHFFFAOYSA-N
XLogP4.02
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.52
LogP ≤ 54.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 1289212
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide
CID 4792730
ethyl 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]benzoate
CID 26969690
N-[2-methoxy-5-[(2-methoxy-5-methylphenyl)sulfamoyl]phenyl]acetamide
CID 7343262
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(2-methylpropyl)benzamide
CID 31324729
N-(3-acetamido-4-methoxyphenyl)-2-(methanesulfonamido)benzamide
CID 25484331
2-[(3,4-dimethylphenyl)sulfonylamino]-N-(4-methoxyphenyl)benzamide
CID 18229347
N-(4-iodophenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 126385456
N-[4-[(2-acetylphenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 8603481
2,3-dimethoxy-N-[4-[(2-methoxy-5-methylphenyl)sulfamoyl]phenyl]benzamide
CID 100530709
N-[2-methoxy-5-[(2-phenoxyphenyl)sulfamoyl]phenyl]acetamide
CID 71903158
2-(benzenesulfonamido)-N-(2,5-dimethoxyphenyl)benzamide
CID 4233924

Frequently Asked Questions

What is the IUPAC name of 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide?
The IUPAC name of 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide (CID 71903202) is 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide.
What is the SMILES notation for 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide?
The canonical SMILES for 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide is COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)Nc2ccc(C)cc2)cc1NC(C)=O.
What is the InChIKey of 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide?
The InChIKey is XUPROSVQESXMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O5S/c1-15-8-10-17(11-9-15)25-23(28)19-6-4-5-7-20(19)26-32(29,30)18-12-13-22(31-3)21(14-18)24-16(2)27/h4-14,26H,1-3H3,(H,24,27)(H,25,28).
What are the key properties of 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide?
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide has a molecular weight of 453.52 g/mol, XLogP of 4.02, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 71903202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).