Found 1 result

Search term: AXRWQAUUTZEPPM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3R,4R,5R)-3-(2,6-Dichlorophenyl)-N-{(1R)-1-[(2R,4S)-4-(dihydroxymethyl)-5,5-dimethyl-1,3-thiazolidin-2-yl]-2-oxoethyl}-5-methyl-1,2-oxazolidine-4-carboxamide | C19H25Cl2N3O5S

(3R,4R,5R)-3-(2,6-Dichlorophenyl)-N-{(1R)-1-[(2R,4S)-4-(dihydroxymethyl)-5,5-dimethyl-1,3-thiazolidin-2-yl]-2-oxoethyl}-5-methyl-1,2-oxazolidine-4-carboxamide

  • Molecular FormulaC19H25Cl2N3O5S
  • Average mass478.390 Da
  • Monoisotopic mass477.089203 Da
  • ChemSpider ID35035852

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(3R,4R,5R)-3-(2,6-Dichlorophenyl)-N-{(1R)-1-[(2R,4S)-4-(dihydroxymethyl)-5,5-dimethyl-1,3-thiazolidin-2-yl]-2-oxoethyl}-5-methyl-1,2-oxazolidine-4-carboxamide [ACD/IUPAC Name]
(3R,4R,5R)-3-(2,6-Dichlorophényl)-N-{(1R)-1-[(2R,4S)-4-(dihydroxyméthyl)-5,5-diméthyl-1,3-thiazolidin-2-yl]-2-oxoéthyl}-5-méthyl-1,2-oxazolidine-4-carboxamide [French] [ACD/IUPAC Name]
(3R,4R,5R)-3-(2,6-Dichlorphenyl)-N-{(1R)-1-[(2R,4S)-4-(dihydroxymethyl)-5,5-dimethyl-1,3-thiazolidin-2-yl]-2-oxoethyl}-5-methyl-1,2-oxazolidin-4-carboxamid [German] [ACD/IUPAC Name]
4-Isoxazolidinecarboxamide, 3-(2,6-dichlorophenyl)-N-[(1R)-1-[(2R,4S)-4-(dihydroxymethyl)-5,5-dimethyl-2-thiazolidinyl]-2-oxoethyl]-5-methyl-, (3R,4R,5R)- [ACD/Index Name]

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: 1.578
Molar Refractivity: 115.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.01
ACD/LogD (pH 5.5): 0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.80
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.19
ACD/KOC (pH 7.4): 111.23
Polar Surface Area: 145 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 348.6±3.0 cm3

Click to predict properties on the Chemicalize site


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