5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione

C21H24N2O2S — CID 24608768

IUPAC5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione
SMILESCCCc1ccc(C2(C)NC(=O)N(Cc3ccc(SC)cc3)C2=O)cc1
InChIInChI=1S/C21H24N2O2S/c1-4-5-15-6-10-17(11-7-15)21(2)19(24)23(20(25)22-21)14-16-8-12-18(26-3)13-9-16/h6-13H,4-5,14H2,1-3H3,(H,22,25)
InChIKeyFBRNTXXWRBWAAG-UHFFFAOYSA-N
MW368.50 g/mol
LogP4.33
Rot. Bonds6

About 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione

5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione (PubChem CID 24608768) has the molecular formula C21H24N2O2S and a molecular weight of 368.50 g/mol. Its IUPAC name is 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione
PubChem CID24608768
Molecular FormulaC21H24N2O2S
Molecular Weight368.50 g/mol
Exact Mass368.16
IUPAC Name5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione
SMILESCCCc1ccc(C2(C)NC(=O)N(Cc3ccc(SC)cc3)C2=O)cc1
InChIInChI=1S/C21H24N2O2S/c1-4-5-15-6-10-17(11-7-15)21(2)19(24)23(20(25)22-21)14-16-8-12-18(26-3)13-9-16/h6-13H,4-5,14H2,1-3H3,(H,22,25)
InChIKeyFBRNTXXWRBWAAG-UHFFFAOYSA-N
XLogP4.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.50
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(5R)-3-[(4-fluorophenyl)methyl]-5-methyl-5-(4-propylphenyl)imidazolidine-2,4-dione
CID 26685769
(5S)-5-(2,3-dihydro-1H-inden-5-yl)-5-methyl-3-[(4-methylsulfanylphenyl)methyl]imidazolidine-2,4-dione
CID 7988392
(5R)-5-(3-bromophenyl)-5-methyl-3-[(4-methylsulfanylphenyl)methyl]imidazolidine-2,4-dione
CID 7178072
3-[[1-(difluoromethyl)imidazol-2-yl]methyl]-5-methyl-5-(4-propylphenyl)imidazolidine-2,4-dione
CID 78828597
(5R)-3-[(4-chlorophenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 2092267
3-[2-(4-fluorophenoxy)ethyl]-5-methyl-5-(4-propylphenyl)imidazolidine-2,4-dione
CID 46615775
3-[2-(4-ethylphenyl)-2-oxoethyl]-5-methyl-5-(4-propylphenyl)imidazolidine-2,4-dione
CID 46815454
(5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 51463779
3-[(4-tert-butylphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 4084225
3-[(4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 16577297
3-[2-(2-fluorophenoxy)ethyl]-5-methyl-5-(4-propylphenyl)imidazolidine-2,4-dione
CID 46815465
N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide
CID 45356013

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione?
The IUPAC name of 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione (CID 24608768) is 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione is CCCc1ccc(C2(C)NC(=O)N(Cc3ccc(SC)cc3)C2=O)cc1.
What is the InChIKey of 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione?
The InChIKey is FBRNTXXWRBWAAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2S/c1-4-5-15-6-10-17(11-7-15)21(2)19(24)23(20(25)22-21)14-16-8-12-18(26-3)13-9-16/h6-13H,4-5,14H2,1-3H3,(H,22,25).
What are the key properties of 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione?
5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione has a molecular weight of 368.50 g/mol, XLogP of 4.33, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(4-methylsulfanylphenyl)methyl]-5-(4-propylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 24608768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).