N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide

C24H23N3O4S — CID 55692087

IUPACN-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
SMILESCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(NS(=O)(=O)/C=C/c3ccccc3)cc2)c1
InChIInChI=1S/C24H23N3O4S/c1-17-8-11-22(25-18(2)28)16-23(17)26-24(29)20-9-12-21(13-10-20)27-32(30,31)15-14-19-6-4-3-5-7-19/h3-16,27H,1-2H3,(H,25,28)(H,26,29)/b15-14+
InChIKeyLPQWIQLNQIZJFO-CCEZHUSRSA-N
MW449.53 g/mol
LogP4.62
Rot. Bonds7

About N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide

N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide (PubChem CID 55692087) has the molecular formula C24H23N3O4S and a molecular weight of 449.53 g/mol. Its IUPAC name is N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
PubChem CID55692087
Molecular FormulaC24H23N3O4S
Molecular Weight449.53 g/mol
Exact Mass449.14
IUPAC NameN-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
SMILESCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(NS(=O)(=O)/C=C/c3ccccc3)cc2)c1
InChIInChI=1S/C24H23N3O4S/c1-17-8-11-22(25-18(2)28)16-23(17)26-24(29)20-9-12-21(13-10-20)27-32(30,31)15-14-19-6-4-3-5-7-19/h3-16,27H,1-2H3,(H,25,28)(H,26,29)/b15-14+
InChIKeyLPQWIQLNQIZJFO-CCEZHUSRSA-N
XLogP4.62
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.53
LogP ≤ 54.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide with MolForge

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Related Compounds

N-(2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 9341925
N-(3-methyl-2-pyridinyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 24981657
N-(3-ethylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 27256502
N-(4-ethylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 9164162
(E)-N-(3-iodo-4-methylphenyl)-2-phenylethenesulfonamide
CID 26950528
ethyl 4-[[4-[[(E)-2-phenylethenyl]sulfonylamino]benzoyl]amino]benzoate
CID 24640952
N-[3-(dimethylsulfamoyl)phenyl]-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 6218294
N-[4-(3-methylbutanoylamino)phenyl]-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 33033292
N-(4-ethoxyphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 24638590
N-(5-acetamido-2-methylphenyl)-4-fluorobenzamide
CID 60764705
N-(1-methylpyrazol-3-yl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 17480120
(E)-N-[4-[[[2-(3,4-dimethylphenoxy)acetyl]amino]carbamoyl]phenyl]-2-phenylethenesulfonamide
CID 55350825

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The IUPAC name of N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide (CID 55692087) is N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide.
What is the SMILES notation for N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The canonical SMILES for N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide is CC(=O)Nc1ccc(C)c(NC(=O)c2ccc(NS(=O)(=O)/C=C/c3ccccc3)cc2)c1.
What is the InChIKey of N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The InChIKey is LPQWIQLNQIZJFO-CCEZHUSRSA-N. The full InChI is InChI=1S/C24H23N3O4S/c1-17-8-11-22(25-18(2)28)16-23(17)26-24(29)20-9-12-21(13-10-20)27-32(30,31)15-14-19-6-4-3-5-7-19/h3-16,27H,1-2H3,(H,25,28)(H,26,29)/b15-14+.
What are the key properties of N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide has a molecular weight of 449.53 g/mol, XLogP of 4.62, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide is sourced from PubChem (CID 55692087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).