N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

C22H24F2N4O5S — CID 40814427

IUPACN-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2C(=O)N[C@](C)(c3cc(F)ccc3F)C2=O)cc1
InChIInChI=1S/C22H24F2N4O5S/c1-4-27(5-2)34(32,33)16-9-7-15(8-10-16)25-19(29)13-28-20(30)22(3,26-21(28)31)17-12-14(23)6-11-18(17)24/h6-12H,4-5,13H2,1-3H3,(H,25,29)(H,26,31)/t22-/m1/s1
InChIKeyKZYJHXSOSDRDAL-JOCHJYFZSA-N
MW494.52 g/mol
LogP2.40
Rot. Bonds8

About N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 40814427) has the molecular formula C22H24F2N4O5S and a molecular weight of 494.52 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID40814427
Molecular FormulaC22H24F2N4O5S
Molecular Weight494.52 g/mol
Exact Mass494.14
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2C(=O)N[C@](C)(c3cc(F)ccc3F)C2=O)cc1
InChIInChI=1S/C22H24F2N4O5S/c1-4-27(5-2)34(32,33)16-9-7-15(8-10-16)25-19(29)13-28-20(30)22(3,26-21(28)31)17-12-14(23)6-11-18(17)24/h6-12H,4-5,13H2,1-3H3,(H,25,29)(H,26,31)/t22-/m1/s1
InChIKeyKZYJHXSOSDRDAL-JOCHJYFZSA-N
XLogP2.40
TPSA115.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500494.52
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-(4-acetylphenyl)-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7801295
N-(4-acetylphenyl)-2-[(4S)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7801296
4-[[2-[(4S)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N,N-dimethylbenzamide
CID 30123684
4-[[2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]benzamide
CID 7561970
N-[4-(diethylsulfamoyl)phenyl]-2-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7916612
N-[4-(diethylsulfamoyl)phenyl]-2-[(4S)-6-fluoro-1,1,2',5'-tetraoxospiro[2,3-dihydrothiochromene-4,4'-imidazolidine]-1'-yl]acetamide
CID 97353813
N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-6-fluoro-1,1,2',5'-tetraoxospiro[2,3-dihydrothiochromene-4,4'-imidazolidine]-1'-yl]acetamide
CID 97353814
N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 16614144
2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide
CID 40985259
2-[(4S)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N,N-di(propan-2-yl)acetamide
CID 7801378
N-(3-cyanophenyl)-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7561950
2-[(4S)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2-methylsulfanylphenyl)acetamide
CID 7801292

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (CID 40814427) is N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2C(=O)N[C@](C)(c3cc(F)ccc3F)C2=O)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is KZYJHXSOSDRDAL-JOCHJYFZSA-N. The full InChI is InChI=1S/C22H24F2N4O5S/c1-4-27(5-2)34(32,33)16-9-7-15(8-10-16)25-19(29)13-28-20(30)22(3,26-21(28)31)17-12-14(23)6-11-18(17)24/h6-12H,4-5,13H2,1-3H3,(H,25,29)(H,26,31)/t22-/m1/s1.
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 494.52 g/mol, XLogP of 2.40, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 40814427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).