chempirical

4-(3-(4-Hydroxybutyl)-4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile

C17H18F3N3O3CAS 154992-24-2369.34 g/mol

Open in Covalent MOL file
ONNFFFONHO
AlcoholAlkyl halideAmideLactamNitrileUrea

Properties

Molecular formula
C17H18F3N3O3
Molar mass
369.34 g/mol
Exact mass
369.1300 Da
logP
2.90Crippen estimate
Polar surface area
84.6 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
154992-24-2
SMILES
CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=O)N1CCCCO
InChIKey
ARBYGDBJECGMGA-UHFFFAOYSA-N
InChI
InChI=1S/C17H18F3N3O3/c1-16(2)14(25)23(15(26)22(16)7-3-4-8-24)12-6-5-11(10-21)13(9-12)17(18,19)20/h5-6,9,24H,3-4,7-8H2,1-2H3

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Names and synonyms

5 names
  • 4-[3-(4-Hydroxybutyl)-4,4-dimethyl-2,5-dioxo-1-imidazolidinyl]-2-(trifluoromethyl)benzonitrile
  • Benzonitrile, 4-[3-(4-hydroxybutyl)-4,4-dimethyl-2,5-dioxo-1-imidazolidinyl]-2-(trifluoromethyl)-
  • RU 58841
  • 4-(4,4-Dimethyl-2,5-dioxo-3-(4-hydroxybutyl)1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile
  • 4-[3-(4-Hydroxybutyl)-4,4-dimethyl-2,5-dioxo-1-imidazolidinyl]-2-trifluoromethylbenzonitrile

Work with 4-(3-(4-Hydroxybutyl)-4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile

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Similar compounds

Enzalutamide carboxylic acid1242137-15-049 % similar 4-[3-[4-Cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-thioxo-1-imidazolidinyl]-2-fluorobenzamide1242137-16-148 % similar Enzalutamide915087-33-147 % similar 4-[(2R)-2-[(1R)-2,2,2-Trifluoro-1-hydroxyethyl]-1-pyrrolidinyl]-2-(trifluoromethyl)benzonitrile1165910-22-440 % similar 4-Hydroxy-2-(trifluoromethyl)benzonitrile320-42-337 % similar 4-Chloro-2-(trifluoromethyl)benzonitrile320-41-236 % similar N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methyl-2-oxiranecarboxamide90357-51-036 % similar 2,4-Bis(trifluoromethyl)benzonitrile177952-38-435 % similar

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

Same formula

Fleroxacin79660-72-3

Elsewhere

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