3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one

C20H23ClN2O5S — CID 68703096

IUPAC3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one
SMILESCS(=O)(=O)CCN1CC(c2cccc(OCCO)c2)N(c2ccc(Cl)cc2)C1=O
InChIInChI=1S/C20H23ClN2O5S/c1-29(26,27)12-9-22-14-19(15-3-2-4-18(13-15)28-11-10-24)23(20(22)25)17-7-5-16(21)6-8-17/h2-8,13,19,24H,9-12,14H2,1H3
InChIKeyDWAAJHGNACZURD-UHFFFAOYSA-N
MW438.93 g/mol
LogP2.74
Rot. Bonds8

About 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one

3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one (PubChem CID 68703096) has the molecular formula C20H23ClN2O5S and a molecular weight of 438.93 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one.

Molecular Properties

Compound Name3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one
PubChem CID68703096
Molecular FormulaC20H23ClN2O5S
Molecular Weight438.93 g/mol
Exact Mass438.10
IUPAC Name3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one
SMILESCS(=O)(=O)CCN1CC(c2cccc(OCCO)c2)N(c2ccc(Cl)cc2)C1=O
InChIInChI=1S/C20H23ClN2O5S/c1-29(26,27)12-9-22-14-19(15-3-2-4-18(13-15)28-11-10-24)23(20(22)25)17-7-5-16(21)6-8-17/h2-8,13,19,24H,9-12,14H2,1H3
InChIKeyDWAAJHGNACZURD-UHFFFAOYSA-N
XLogP2.74
TPSA87.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.93
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one?
The IUPAC name of 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one (CID 68703096) is 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one.
What is the SMILES notation for 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one?
The canonical SMILES for 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one is CS(=O)(=O)CCN1CC(c2cccc(OCCO)c2)N(c2ccc(Cl)cc2)C1=O.
What is the InChIKey of 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one?
The InChIKey is DWAAJHGNACZURD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O5S/c1-29(26,27)12-9-22-14-19(15-3-2-4-18(13-15)28-11-10-24)23(20(22)25)17-7-5-16(21)6-8-17/h2-8,13,19,24H,9-12,14H2,1H3.
What are the key properties of 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one?
3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one has a molecular weight of 438.93 g/mol, XLogP of 2.74, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-4-[3-(2-hydroxyethoxy)phenyl]-1-(2-methylsulfonylethyl)imidazolidin-2-one is sourced from PubChem (CID 68703096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).