ChemSpider 2D Image | Ethyl [(5-{[(2,2-dioxido-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazin-7-yl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]acetate | C14H15N5O5S3

Ethyl [(5-{[(2,2-dioxido-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazin-7-yl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]acetate

  • Molecular FormulaC14H15N5O5S3
  • Average mass429.494 Da
  • Monoisotopic mass429.023529 Da
  • ChemSpider ID69963343

More details:

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

[(5-{[(2,2-Dioxydo-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazin-7-yl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]acétate d'éthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[[5-[[(3,4-dihydro-2,2-dioxidopyrido[2,1-c][1,2,4]thiadiazin-7-yl)carbonyl]amino]-1,3,4-thiadiazol-2-yl]thio]-, ethyl ester [ACD/Index Name]
Ethyl [(5-{[(2,2-dioxido-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazin-7-yl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]acetate [ACD/IUPAC Name]
Ethyl-[(5-{[(2,2-dioxido-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazin-7-yl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]acetat [German] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.764
Molar Refractivity: 103.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.11
ACD/LogD (pH 5.5): 0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.73
ACD/LogD (pH 7.4): -0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.03
Polar Surface Area: 193 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 77.7±7.0 dyne/cm
Molar Volume: 251.5±7.0 cm3

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