4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide

C23H22N2O3S — CID 9315088

IUPAC4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
SMILESC[C@H](NC(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C23H22N2O3S/c1-18(20-10-6-3-7-11-20)24-23(26)21-12-14-22(15-13-21)25-29(27,28)17-16-19-8-4-2-5-9-19/h2-18,25H,1H3,(H,24,26)/b17-16+/t18-/m0/s1
InChIKeyXRHNACBOCNLYEX-GVJQPLCZSA-N
MW406.51 g/mol
LogP4.59
Rot. Bonds7

About 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide

4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide (PubChem CID 9315088) has the molecular formula C23H22N2O3S and a molecular weight of 406.51 g/mol. Its IUPAC name is 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
PubChem CID9315088
Molecular FormulaC23H22N2O3S
Molecular Weight406.51 g/mol
Exact Mass406.14
IUPAC Name4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
SMILESC[C@H](NC(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C23H22N2O3S/c1-18(20-10-6-3-7-11-20)24-23(26)21-12-14-22(15-13-21)25-29(27,28)17-16-19-8-4-2-5-9-19/h2-18,25H,1H3,(H,24,26)/b17-16+/t18-/m0/s1
InChIKeyXRHNACBOCNLYEX-GVJQPLCZSA-N
XLogP4.59
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.51
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(furan-2-yl)propan-2-yl]-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 55620096
N-[4-(3-methylbutanoylamino)phenyl]-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 33033292
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 43009019
N-(2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 9341925
4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 9315283
4-[(4-bromophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 2090399
4-[(4-fluorophenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 9315282
4-acetamido-N-(1-phenylethyl)benzamide
CID 2841785
4-hydrazinyl-N-(1-phenylethyl)benzamide
CID 62248478
4-benzamido-N-(1-phenylethyl)benzamide
CID 17153199
N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 24542624
ethyl 4-[[4-[[(E)-2-phenylethenyl]sulfonylamino]benzoyl]amino]benzoate
CID 24640952

Frequently Asked Questions

What is the IUPAC name of 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide?
The IUPAC name of 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide (CID 9315088) is 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide.
What is the SMILES notation for 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide?
The canonical SMILES for 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide is C[C@H](NC(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)c1ccccc1.
What is the InChIKey of 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide?
The InChIKey is XRHNACBOCNLYEX-GVJQPLCZSA-N. The full InChI is InChI=1S/C23H22N2O3S/c1-18(20-10-6-3-7-11-20)24-23(26)21-12-14-22(15-13-21)25-29(27,28)17-16-19-8-4-2-5-9-19/h2-18,25H,1H3,(H,24,26)/b17-16+/t18-/m0/s1.
What are the key properties of 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide?
4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide has a molecular weight of 406.51 g/mol, XLogP of 4.59, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide is sourced from PubChem (CID 9315088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).