ChemSpider 2D Image | (6R,7R)-7-{[(2Z)-2-[(Fluoromethoxy)imino]-2-(5-imino-2,5-dihydro-1,2,4-thiadiazol-3-yl)acetyl]amino}-3-[(E)-{[(E)-imino(1-piperazinyl)methyl](methyl)hydrazono}methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]o ct-2-ene-2-carboxylic acid | C19H24FN11O5S2

(6R,7R)-7-{[(2Z)-2-[(Fluoromethoxy)imino]-2-(5-imino-2,5-dihydro-1,2,4-thiadiazol-3-yl)acetyl]amino}-3-[(E)-{[(E)-imino(1-piperazinyl)methyl](methyl)hydrazono}methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]o ct-2-ene-2-carboxylic acid

  • Molecular FormulaC19H24FN11O5S2
  • Average mass569.593 Da
  • Monoisotopic mass569.138733 Da
  • ChemSpider ID88297344

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(6R,7R)-7-{[(2Z)-2-[(Fluormethoxy)imino]-2-(5-imino-2,5-dihydro-1,2,4-thiadiazol-3-yl)acetyl]amino}-3-[(E)-{[(E)-imino(1-piperazinyl)methyl](methyl)hydrazono}methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oc t-2-en-2-carbonsäure [German] [ACD/IUPAC Name]
(6R,7R)-7-{[(2Z)-2-[(Fluoromethoxy)imino]-2-(5-imino-2,5-dihydro-1,2,4-thiadiazol-3-yl)acetyl]amino}-3-[(E)-{[(E)-imino(1-piperazinyl)methyl](methyl)hydrazono}methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]o ct-2-ene-2-carboxylic acid [ACD/IUPAC Name]
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2Z)-2-(2,5-dihydro-5-imino-1,2,4-thiadiazol-3-yl)-2-[(fluoromethoxy)imino]-1-oxoethyl]amino]-3-[(E)-[2-[(E)-imino-1-piperazinylmethyl]-2-met hylhydrazinylidene]methyl]-8-oxo-, (6R,7R)- [ACD/Index Name]
Acide (6R,7R)-7-{[(2Z)-2-[(fluorométhoxy)imino]-2-(5-imino-2,5-dihydro-1,2,4-thiadiazol-3-yl)acétyl]amino}-3-[(E)-{[(E)-imino(1-pipérazinyl)méthyl](méthyl)hydrazono}méthyl]-8-oxo-5-thia-1-azabicyclo[4 .2.0]oct-2-ène-2-carboxylique [French] [ACD/IUPAC Name]
635292-67-0 [RN]
CB-181963

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.832
Molar Refractivity: 134.0±0.5 cm3
#H bond acceptors: 16
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -2.40
ACD/LogD (pH 5.5): -5.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 262 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 89.7±7.0 dyne/cm
Molar Volume: 304.7±7.0 cm3

Click to predict properties on the Chemicalize site


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