ChemSpider 2D Image | RO4927350 | C27H28N4O6S

RO4927350

  • Molecular FormulaC27H28N4O6S
  • Average mass536.599 Da
  • Monoisotopic mass536.172974 Da
  • ChemSpider ID9701457

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2S,3S)-2-{(4R)-4-[4-(2-Hydroxyethoxy)phenyl]-2,5-dioxo-1-imidazolidinyl}-3-phenyl-N-(4-propionyl-1,3-thiazol-2-yl)butanamid [German] [ACD/IUPAC Name]
(2S,3S)-2-{(4R)-4-[4-(2-Hydroxyethoxy)phenyl]-2,5-dioxo-1-imidazolidinyl}-3-phenyl-N-(4-propionyl-1,3-thiazol-2-yl)butanamide [ACD/IUPAC Name]
(2S,3S)-2-{(4R)-4-[4-(2-Hydroxyéthoxy)phényl]-2,5-dioxo-1-imidazolidinyl}-3-phényl-N-(4-propionyl-1,3-thiazol-2-yl)butanamide [French] [ACD/IUPAC Name]
1-Imidazolidineacetamide, 4-[4-(2-hydroxyethoxy)phenyl]-2,5-dioxo-N-[4-(1-oxopropyl)-2-thiazolyl]-α-[(1S)-1-phenylethyl]-, (αS,4R)- [ACD/Index Name]
876755-27-0 [RN]
RO4927350
(2S,3S)-2-{(4R)-4-[4-(2-hydroxyethoxy)phenyl]-2,5-dioxoimidazolidin-1-yl}-3-phenyl-N-(4-propionyl-1,3-thiazol-2-yl)butanamide
Ro 4927350
RO-4927350
  • Miscellaneous

    • Chemical Class:

      A carboxamide resulting from the formal condensation of the primary amino group of 4-propanoyl-1,3-thiazol-2-amine with the carboxy group of a 3-phenylbutiyric acid which has been substituted at posit ion 2 by a (4<stereo>R</stereo>)-4-[<ital>p</ital>-(2-hydroxyethoxy)phenyl]-2,5-dioxoimidazolidin-1-yl group. It is a potent, highly selective inhibitormitogen-activated protein kinase 1/2 inhibitor. ChEBI CHEBI:132984
      A carboxamide resulting from the formal condensation of the primary amino group of 4-propanoyl-1,3-thiazol-2-amine with the carboxy group of a 3-phenylbutiyric acid which has been substituted at posit ion 2 by a (4R)-4-[p-(2-hydroxyethoxy)phenyl]-2,5-dioxoimidazolidin-1-yl group. It is a potent, highly selective inhibitormitogen-activated protein kinase 1/2 inhibitor. ChEBI CHEBI:132984

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.641
Molar Refractivity: 141.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 68.70
ACD/KOC (pH 5.5): 714.20
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 21.50
ACD/KOC (pH 7.4): 223.52
Polar Surface Area: 166 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 64.8±3.0 dyne/cm
Molar Volume: 392.8±3.0 cm3

Click to predict properties on the Chemicalize site


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