(5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione

C24H22N2O2 — CID 7240287

IUPAC(5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione
SMILESCc1ccc(CN2C(=O)N[C@@](Cc3ccccc3)(c3ccccc3)C2=O)cc1
InChIInChI=1S/C24H22N2O2/c1-18-12-14-20(15-13-18)17-26-22(27)24(25-23(26)28,21-10-6-3-7-11-21)16-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,25,28)/t24-/m0/s1
InChIKeyMRSDMUHNIQRRJA-DEOSSOPVSA-N
MW370.45 g/mol
LogP4.19
Rot. Bonds5

About (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione

(5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione (PubChem CID 7240287) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione
PubChem CID7240287
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name(5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione
SMILESCc1ccc(CN2C(=O)N[C@@](Cc3ccccc3)(c3ccccc3)C2=O)cc1
InChIInChI=1S/C24H22N2O2/c1-18-12-14-20(15-13-18)17-26-22(27)24(25-23(26)28,21-10-6-3-7-11-21)16-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,25,28)/t24-/m0/s1
InChIKeyMRSDMUHNIQRRJA-DEOSSOPVSA-N
XLogP4.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 54.19
H-Bond Donors ≤ 51
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)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione?
The IUPAC name of (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione (CID 7240287) is (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione is Cc1ccc(CN2C(=O)N[C@@](Cc3ccccc3)(c3ccccc3)C2=O)cc1.
What is the InChIKey of (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione?
The InChIKey is MRSDMUHNIQRRJA-DEOSSOPVSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-18-12-14-20(15-13-18)17-26-22(27)24(25-23(26)28,21-10-6-3-7-11-21)16-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,25,28)/t24-/m0/s1.
What are the key properties of (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione?
(5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione has a molecular weight of 370.45 g/mol, XLogP of 4.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-benzyl-3-[(4-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 7240287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).