chempirical

5-(Phenylmethyl)-2,4-imidazolidinedione

C10H10N2O2CAS 3530-82-3190.20 g/mol

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Properties

Molecular formula
C10H10N2O2
Molar mass
190.20 g/mol
Exact mass
190.0742 Da
Melting point
188–189 °C
logP
1.48Crippen estimate
Polar surface area
65.2 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Identifiers

CAS number
3530-82-3
SMILES
OC1=NC(Cc2ccccc2)C(O)=N1
InChIKey
DBOMTIHROGSFTI-UHFFFAOYSA-N
InChI
InChI=1S/C10H10N2O2/c13-9-8(11-10(14)12-9)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H2,11,12,13,14)

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Names and synonyms

7 names
  • 2,4-Imidazolidinedione, 5-(phenylmethyl)-
  • Hydantoin, 5-benzyl-
  • 5-Benzylhydantoin
  • Benzylhydantoin
  • DL-5-Benzylhydantoin
  • NSC 30459
  • NSC 50842

Work with 5-(Phenylmethyl)-2,4-imidazolidinedione

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Phenylhydantoin89-24-753 % similar L-Phenylalanyl-L-phenylalanine2577-40-448 % similar Glycylphenylalanine3321-03-747 % similar Glycylphenylalanine721-66-447 % similar Benzoyl-L-phenylalanine2566-22-546 % similar N-Benzoyl-dl-phenylalanine2901-76-046 % similar Alanylphenylalanine1999-45-746 % similar L-Alanyl-L-phenylalanine3061-90-346 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methyl 4-amino-6-indolecarboxylate121561-15-7 3-Benzoimidazol-1-yl-propionic acid14840-18-7 2,3-Dimethyl-5-nitro-1H-indole21296-94-6 1H-Benzimidazole-2-propanoic acid23249-97-0 2-Cyano-D-phenylalanine263396-41-4 3-Cyano-D-phenylalanine263396-43-6 2,3-Dimethyl-7-nitro-1H-indole41018-86-4 Ethyl 3-indazolecarboxylate4498-68-4

Elsewhere

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