(4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one

C16H16N2O3S — CID 163902103

IUPAC(4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one
SMILESCS(=O)(=O)c1ccc(N2C[C@@H](c3ccccc3)NC2=O)cc1
InChIInChI=1S/C16H16N2O3S/c1-22(20,21)14-9-7-13(8-10-14)18-11-15(17-16(18)19)12-5-3-2-4-6-12/h2-10,15H,11H2,1H3,(H,17,19)/t15-/m0/s1
InChIKeyQKTFBPIIYFMBBF-HNNXBMFYSA-N
MW316.38 g/mol
LogP2.36
Rot. Bonds3

About (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one

(4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one (PubChem CID 163902103) has the molecular formula C16H16N2O3S and a molecular weight of 316.38 g/mol. Its IUPAC name is (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one.

Molecular Properties

Compound Name(4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one
PubChem CID163902103
Molecular FormulaC16H16N2O3S
Molecular Weight316.38 g/mol
Exact Mass316.09
IUPAC Name(4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one
SMILESCS(=O)(=O)c1ccc(N2C[C@@H](c3ccccc3)NC2=O)cc1
InChIInChI=1S/C16H16N2O3S/c1-22(20,21)14-9-7-13(8-10-14)18-11-15(17-16(18)19)12-5-3-2-4-6-12/h2-10,15H,11H2,1H3,(H,17,19)/t15-/m0/s1
InChIKeyQKTFBPIIYFMBBF-HNNXBMFYSA-N
XLogP2.36
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one?
The IUPAC name of (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one (CID 163902103) is (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one.
What is the SMILES notation for (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one?
The canonical SMILES for (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one is CS(=O)(=O)c1ccc(N2C[C@@H](c3ccccc3)NC2=O)cc1.
What is the InChIKey of (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one?
The InChIKey is QKTFBPIIYFMBBF-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H16N2O3S/c1-22(20,21)14-9-7-13(8-10-14)18-11-15(17-16(18)19)12-5-3-2-4-6-12/h2-10,15H,11H2,1H3,(H,17,19)/t15-/m0/s1.
What are the key properties of (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one?
(4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one has a molecular weight of 316.38 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one is sourced from PubChem (CID 163902103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).