ChemSpider 2D Image | (2R)-2-[(1S)-1-(Benzoylamino)-1-methoxy-2-oxoethyl]-5-methylene-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid | C16H16N2O5S

(2R)-2-[(1S)-1-(Benzoylamino)-1-methoxy-2-oxoethyl]-5-methylene-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid

  • Molecular FormulaC16H16N2O5S
  • Average mass348.374 Da
  • Monoisotopic mass348.078003 Da
  • ChemSpider ID35035772

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R)-2-[(1S)-1-(Benzoylamino)-1-methoxy-2-oxoethyl]-5-methylen-5,6-dihydro-2H-1,3-thiazin-4-carbonsäure [German] [ACD/IUPAC Name]
(2R)-2-[(1S)-1-(Benzoylamino)-1-methoxy-2-oxoethyl]-5-methylene-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid [ACD/IUPAC Name]
(2r)-2-[(1s)-1-(Benzoylamino)-1-Methoxy-2-Oxoethyl]-5-Methylidene-5,6-Dihydro-2h-1,3-Thiazine-4-Carboxylic Acid
2H-1,3-Thiazine-4-carboxylic acid, 2-[(1S)-1-(benzoylamino)-1-methoxy-2-oxoethyl]-5,6-dihydro-5-methylene-, (2R)- [ACD/Index Name]
Acide (2R)-2-[(1S)-1-(benzoylamino)-1-méthoxy-2-oxoéthyl]-5-méthylène-5,6-dihydro-2H-1,3-thiazine-4-carboxylique [French] [ACD/IUPAC 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: 1.620
Molar Refractivity: 90.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.50
ACD/LogD (pH 5.5): -1.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 130 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 53.5±7.0 dyne/cm
Molar Volume: 256.3±7.0 cm3

Click to predict properties on the Chemicalize site


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