4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide

C21H19FN2O3S — CID 9315283

IUPAC4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)c1ccccc1
InChIInChI=1S/C21H19FN2O3S/c1-15(16-5-3-2-4-6-16)23-21(25)17-7-11-19(12-8-17)24-28(26,27)20-13-9-18(22)10-14-20/h2-15,24H,1H3,(H,23,25)/t15-/m1/s1
InChIKeyVCCCUCUHHPGEFA-OAHLLOKOSA-N
MW398.46 g/mol
LogP4.12
Rot. Bonds6

About 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide

4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide (PubChem CID 9315283) has the molecular formula C21H19FN2O3S and a molecular weight of 398.46 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
PubChem CID9315283
Molecular FormulaC21H19FN2O3S
Molecular Weight398.46 g/mol
Exact Mass398.11
IUPAC Name4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)c1ccccc1
InChIInChI=1S/C21H19FN2O3S/c1-15(16-5-3-2-4-6-16)23-21(25)17-7-11-19(12-8-17)24-28(26,27)20-13-9-18(22)10-14-20/h2-15,24H,1H3,(H,23,25)/t15-/m1/s1
InChIKeyVCCCUCUHHPGEFA-OAHLLOKOSA-N
XLogP4.12
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.46
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-fluorophenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 9315282
4-[(4-bromophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 2090399
4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164346
4-(phenylsulfamoyl)-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 2446305
4-(phenylsulfamoyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 2446308
5-[(4-fluorophenyl)sulfamoyl]-2-methyl-N-(1-phenylethyl)benzamide
CID 46522983
3-(benzenesulfonamido)-N-[(1S)-1-(4-fluorophenyl)ethyl]benzamide
CID 9409977
N-[(1R)-1-(4-fluorophenyl)ethyl]-3-[(4-fluorophenyl)sulfamoyl]benzamide
CID 9410285
N-[1-(2,5-difluorophenyl)ethyl]-4-(phenylsulfamoyl)benzamide
CID 46460775
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-(methylsulfamoyl)benzamide
CID 51537719
N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 132672025
4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide
CID 2687763

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide?
The IUPAC name of 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide (CID 9315283) is 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide.
What is the SMILES notation for 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide?
The canonical SMILES for 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide is C[C@@H](NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)c1ccccc1.
What is the InChIKey of 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide?
The InChIKey is VCCCUCUHHPGEFA-OAHLLOKOSA-N. The full InChI is InChI=1S/C21H19FN2O3S/c1-15(16-5-3-2-4-6-16)23-21(25)17-7-11-19(12-8-17)24-28(26,27)20-13-9-18(22)10-14-20/h2-15,24H,1H3,(H,23,25)/t15-/m1/s1.
What are the key properties of 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide?
4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide has a molecular weight of 398.46 g/mol, XLogP of 4.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide is sourced from PubChem (CID 9315283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).