1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one

C17H15F3N2O4S — CID 137443819

IUPAC1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one
SMILESCOc1ccc(S(=O)(=O)N2CCN(c3ccc(C(F)(F)F)cc3)C2=O)cc1
InChIInChI=1S/C17H15F3N2O4S/c1-26-14-6-8-15(9-7-14)27(24,25)22-11-10-21(16(22)23)13-4-2-12(3-5-13)17(18,19)20/h2-9H,10-11H2,1H3
InChIKeyZDQVKDVGARGGFQ-UHFFFAOYSA-N
MW400.38 g/mol
LogP3.34
Rot. Bonds4

About 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one

1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one (PubChem CID 137443819) has the molecular formula C17H15F3N2O4S and a molecular weight of 400.38 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one
PubChem CID137443819
Molecular FormulaC17H15F3N2O4S
Molecular Weight400.38 g/mol
Exact Mass400.07
IUPAC Name1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one
SMILESCOc1ccc(S(=O)(=O)N2CCN(c3ccc(C(F)(F)F)cc3)C2=O)cc1
InChIInChI=1S/C17H15F3N2O4S/c1-26-14-6-8-15(9-7-14)27(24,25)22-11-10-21(16(22)23)13-4-2-12(3-5-13)17(18,19)20/h2-9H,10-11H2,1H3
InChIKeyZDQVKDVGARGGFQ-UHFFFAOYSA-N
XLogP3.34
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.38
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-(Diethylamino)benzyl)-4-methoxy-N-(p-tolyl)benzenesulfonamide
CID 71584280
3-(3,4-Dimethoxy-benzenesulfonyl)-1-(3,4-dimethyl-phenyl)-imidazolidine-2,4-dione
CID 10431323
3-(4-Methoxy-benzenesulfonyl)-1-phenyl-imidazolidine-2,4-dione
CID 10545533
3-(3-Methoxy-benzenesulfonyl)-1-phenyl-imidazolidine-2,4-dione
CID 10736348
4-Methoxy-N-{3-[4-(p-trifluoromethylphenyl)-piperazin-1-yl]-propyl}-benzenesulfonamide
CID 42635028
(2R)-4-(4-Fluoro-2-(trifluoromethyl)phenyl)-1-(4-methoxyphenylsulfonyl)-2-methylpiperazine
CID 44248580
N-[4-(difluoromethoxy)phenyl]-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
CID 53373004
N-[[4-(4-acetylpiperazin-1-yl)-2-fluorophenyl]methyl]-N-cyclobutyl-4-(trifluoromethoxy)benzenesulfonamide
CID 89659406
N-[[4-(4-acetylpiperazin-1-yl)-2-fluorophenyl]methyl]-N-cyclobutyl-4-methoxybenzenesulfonamide
CID 89659420
N-[[4-(4-acetylpiperazin-1-yl)-2-fluorophenyl]methyl]-N-cyclobutyl-3-methoxybenzenesulfonamide
CID 89659441
N-[[4-(4-acetylpiperazin-1-yl)-2-fluorophenyl]methyl]-N-cyclobutyl-4-(difluoromethoxy)benzenesulfonamide
CID 89701026
1-((4-methoxyphenyl)sulfonyl)-N-(p-tolyl)pyrrolidine-2-carboxamide
CID 651337

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one?
The IUPAC name of 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one (CID 137443819) is 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one is COc1ccc(S(=O)(=O)N2CCN(c3ccc(C(F)(F)F)cc3)C2=O)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one?
The InChIKey is ZDQVKDVGARGGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3N2O4S/c1-26-14-6-8-15(9-7-14)27(24,25)22-11-10-21(16(22)23)13-4-2-12(3-5-13)17(18,19)20/h2-9H,10-11H2,1H3.
What are the key properties of 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one?
1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one has a molecular weight of 400.38 g/mol, XLogP of 3.34, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one is sourced from PubChem (CID 137443819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).