3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione

C16H14N2O5S — CID 10736348

IUPAC3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione
SMILESCOc1cccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)c1
InChIInChI=1S/C16H14N2O5S/c1-23-13-8-5-9-14(10-13)24(21,22)18-15(19)11-17(16(18)20)12-6-3-2-4-7-12/h2-10H,11H2,1H3
InChIKeyKDVFGQRTDBJTGS-UHFFFAOYSA-N
MW346.36 g/mol
LogP1.85
Rot. Bonds4

About 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione

3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione (PubChem CID 10736348) has the molecular formula C16H14N2O5S and a molecular weight of 346.36 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione
PubChem CID10736348
Molecular FormulaC16H14N2O5S
Molecular Weight346.36 g/mol
Exact Mass346.06
IUPAC Name3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione
SMILESCOc1cccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)c1
InChIInChI=1S/C16H14N2O5S/c1-23-13-8-5-9-14(10-13)24(21,22)18-15(19)11-17(16(18)20)12-6-3-2-4-7-12/h2-10H,11H2,1H3
InChIKeyKDVFGQRTDBJTGS-UHFFFAOYSA-N
XLogP1.85
TPSA83.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.36
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-Methoxy-phenyl)-N-(2-oxo-2-piperidin-1-yl-ethyl)-benzenesulfonamide
CID 651524
N-(4-{[1-(4-methoxyphenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]sulfamoyl}phenyl)acetamide
CID 2965073
N-[3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)benzenesulfonamide
CID 2884143
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-(3,4-Dimethoxy-benzenesulfonyl)-1-phenyl-imidazolidine-2,4-dione
CID 10714544
3-(4-Phenoxy-benzenesulfonyl)-1-phenyl-imidazolidine-2,4-dione
CID 10740202
3-(3-Phenoxy-benzenesulfonyl)-1-phenyl-imidazolidine-2,4-dione
CID 10835279
(4-Methoxyphenyl) 4-(2-oxoimidazolidin-1-yl)benzenesulfonate
CID 53353818
N-(2-methoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
CID 53372216
N-(4-methoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
CID 53372219
N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
CID 53372868

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione?
The IUPAC name of 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione (CID 10736348) is 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione?
The canonical SMILES for 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione is COc1cccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)c1.
What is the InChIKey of 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione?
The InChIKey is KDVFGQRTDBJTGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O5S/c1-23-13-8-5-9-14(10-13)24(21,22)18-15(19)11-17(16(18)20)12-6-3-2-4-7-12/h2-10H,11H2,1H3.
What are the key properties of 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione?
3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione has a molecular weight of 346.36 g/mol, XLogP of 1.85, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)sulfonyl-1-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 10736348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).