ChemSpider 2D Image | Ethyl 2-{[({4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-2-oxoethyl]-1,2,5-oxadiazol-3-yl}oxy)acetyl]amino}-4-methyl-1,3-thiazole-5-carboxylate | C20H25N5O8S

Ethyl 2-{[({4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-2-oxoethyl]-1,2,5-oxadiazol-3-yl}oxy)acetyl]amino}-4-methyl-1,3-thiazole-5-carboxylate

  • Molecular FormulaC20H25N5O8S
  • Average mass495.506 Da
  • Monoisotopic mass495.142395 Da
  • ChemSpider ID125053786

More details:

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

2-{[2-({4-[2-(1,4-Dioxa-8-azaspiro[4.5]déc-8-yl)-2-oxoéthyl]-1,2,5-oxadiazol-3-yl}oxy)acétyl]amino}-4-méthyl-1,3-thiazole-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-[[2-[[4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-2-oxoethyl]-1,2,5-oxadiazol-3-yl]oxy]acetyl]amino]-4-methyl-, ethyl ester [ACD/Index Name]
Ethyl 2-{[({4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-2-oxoethyl]-1,2,5-oxadiazol-3-yl}oxy)acetyl]amino}-4-methyl-1,3-thiazole-5-carboxylate [ACD/IUPAC Name]
Ethyl-2-{[({4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-2-oxoethyl]-1,2,5-oxadiazol-3-yl}oxy)acetyl]amino}-4-methyl-1,3-thiazol-5-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 115.7±0.4 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 0.74
ACD/LogD (pH 5.5): 0.80
ACD/BCF (pH 5.5): 2.34
ACD/KOC (pH 5.5): 62.15
ACD/LogD (pH 7.4): -0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.59
Polar Surface Area: 183 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 75.1±5.0 dyne/cm
Molar Volume: 335.8±5.0 cm3

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