ChemSpider 2D Image | fenpicoxamid | C31H38N2O11

fenpicoxamid

  • Molecular FormulaC31H38N2O11
  • Average mass614.640 Da
  • Monoisotopic mass614.247559 Da
  • ChemSpider ID57630848

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3S,6S,7R,8R)-8-Benzyl-3-[({3-[(isobutyryloxy)methoxy]-4-methoxy-2-pyridinyl}carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl 2-methylpropanoate (non-preferred name) [ACD/IUPAC Name]
(3S,6S,7R,8R)-8-Benzyl-3-[({3-[(isobutyryloxy)methoxy]-4-methoxy-2-pyridinyl}carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl-2-methylpropanoat (non-preferred name) [German] [ACD/IUPAC Name]
(3S,6S,7R,8R)-8-Benzyl-3-[3-[(isobutyryloxy)methoxy]-4-methoxypicolinamido]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl isobutyrate
2-Méthylpropanoate de (3S,6S,7R,8R)-8-benzyl-3-[({3-[(isobutyryloxy)méthoxy]-4-méthoxy-2-pyridinyl}carbonyl)amino]-6-méthyl-4,9-dioxo-1,5-dioxonan-7-yle (non-preferred name) [French] [ACD/IUPAC Name]
517875-34-2 [RN]
fenpicoxamid
фенпикоксамид [Russian]
(3S,6S,7R,8R)-8-benzyl-3-[({3-[(isobutyryloxy)methoxy]-4-methoxypyridin-2-yl}carbonyl)amino]-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl 2-methylpropanoate
[2-[[(3S,7R,8R,9S)-7-benzyl-9-methyl-8-(2-methylpropanoyloxy)-2,6-dioxo-1,5-dioxonan-3-yl]carbamoyl]-4-methoxypyridin-3-yl]oxymethyl 2-methylpropanoate
Antibiotic UK 2A procide
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  • Miscellaneous

    • Chemical Class:

      A carboxamide resulting from the formal condensation of the carboxy group of 3-[(isobutyryloxy)methoxy]-4-methoxypyridine-2-carboxylic acid with the amino group of (3<stereo>S</stereo>,6<stereo>S</ste reo>,7<stereo>R</stereo>,8<stereo>R</stereo>)-3-amino-8-benzyl-6-methyl-4,9-dioxo-1,5-dioxonan-7-yl 2-methylpropanoate. Introduced by Dow AgroSciences, it is an antibiotic fungicide with a new target site for disease control in <ital>Septoria</ital> species. ChEBI CHEBI:136340
      A carboxamide resulting from the formal condensation of the carboxy group of 3-[(isobutyryloxy)methoxy]-4-methoxypyridine-2-carboxylic acid with the amino group of (3S,6S,7R,8R)-3-amino-8-benzyl-6-met hyl-4,9-dioxo-1,5-dioxonan-7-yl 2-methylpropanoate. Introduced by Dow AgroSciences, it is an antibiotic fungicide with a new target site for disease control in Septoria species. ChEBI CHEBI:136340

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

Density: 1.3±0.1 g/cm3
Boiling Point: 783.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.0±3.0 kJ/mol
Flash Point: 427.6±32.9 °C
Index of Refraction: 1.558
Molar Refractivity: 154.4±0.4 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.92
ACD/KOC (pH 5.5): 620.10
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.92
ACD/KOC (pH 7.4): 620.10
Polar Surface Area: 166 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 55.1±5.0 dyne/cm
Molar Volume: 479.1±5.0 cm3

Click to predict properties on the Chemicalize site


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