(5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione

C18H17ClN2O2 — CID 155515451

IUPAC(5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione
SMILESC[C@H]1C(=O)N(c2ccc(Cl)cc2)C(=O)N1CCc1ccccc1
InChIInChI=1S/C18H17ClN2O2/c1-13-17(22)21(16-9-7-15(19)8-10-16)18(23)20(13)12-11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3/t13-/m0/s1
InChIKeyLTYYEIAHBORAIW-ZDUSSCGKSA-N
MW328.80 g/mol
LogP3.74
Rot. Bonds4

About (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione

(5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione (PubChem CID 155515451) has the molecular formula C18H17ClN2O2 and a molecular weight of 328.80 g/mol. Its IUPAC name is (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione
PubChem CID155515451
Molecular FormulaC18H17ClN2O2
Molecular Weight328.80 g/mol
Exact Mass328.10
IUPAC Name(5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione
SMILESC[C@H]1C(=O)N(c2ccc(Cl)cc2)C(=O)N1CCc1ccccc1
InChIInChI=1S/C18H17ClN2O2/c1-13-17(22)21(16-9-7-15(19)8-10-16)18(23)20(13)12-11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3/t13-/m0/s1
InChIKeyLTYYEIAHBORAIW-ZDUSSCGKSA-N
XLogP3.74
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.80
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione?
The IUPAC name of (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione (CID 155515451) is (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione is C[C@H]1C(=O)N(c2ccc(Cl)cc2)C(=O)N1CCc1ccccc1.
What is the InChIKey of (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione?
The InChIKey is LTYYEIAHBORAIW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C18H17ClN2O2/c1-13-17(22)21(16-9-7-15(19)8-10-16)18(23)20(13)12-11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3/t13-/m0/s1.
What are the key properties of (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione?
(5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione has a molecular weight of 328.80 g/mol, XLogP of 3.74, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-3-(4-chlorophenyl)-5-methyl-1-(2-phenylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 155515451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).