ChemSpider 2D Image | Farinamycin | C21H19N5O7

Farinamycin

  • Molecular FormulaC21H19N5O7
  • Average mass453.405 Da
  • Monoisotopic mass453.128448 Da
  • ChemSpider ID28289273
  • defined stereocentres - 3 of 3 defined stereocentres


More details:



Featured data source



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

(3R,4R,5R)-2-Amino-3,4-dihydroxy-5-{[2-hydroxy-5-(8-hydroxy-4-oxo-1,4-dihydro-2-chinazolinyl)phenyl]amino}-6-oxo-1-cyclohexen-1-carboxamid [German] [ACD/IUPAC Name]
(3R,4R,5R)-2-Amino-3,4-dihydroxy-5-{[2-hydroxy-5-(8-hydroxy-4-oxo-1,4-dihydro-2-quinazolinyl)phenyl]amino}-6-oxo-1-cyclohexene-1-carboxamide [ACD/IUPAC Name]
(3R,4R,5R)-2-Amino-3,4-dihydroxy-5-{[2-hydroxy-5-(8-hydroxy-4-oxo-1,4-dihydro-2-quinazolinyl)phényl]amino}-6-oxo-1-cyclohexène-1-carboxamide [French] [ACD/IUPAC Name]
1-Cyclohexene-1-carboxamide, 2-amino-5-[[5-(3,4-dihydro-8-hydroxy-4-oxo-2-quinazolinyl)-2-hydroxyphenyl]amino]-3,4-dihydroxy-6-oxo-, (3R,4R,5R)- [ACD/Index Name]
Farinamycin [Wiki]
E'farinamycin'

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.836
Molar Refractivity: 108.1±0.5 cm3
#H bond acceptors: 12
#H bond donors: 10
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.26
ACD/LogD (pH 5.5): -1.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.27
ACD/LogD (pH 7.4): -1.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.06
Polar Surface Area: 221 Å2
Polarizability: 42.8±0.5 10-24cm3
Surface Tension: 92.4±7.0 dyne/cm
Molar Volume: 244.9±7.0 cm3

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