ChemSpider 2D Image | Ceftolozane | C23H30N12O8S2

Ceftolozane

  • Molecular FormulaC23H30N12O8S2
  • Average mass666.690 Da
  • Monoisotopic mass666.175110 Da
  • ChemSpider ID28475343

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

Featured data source
The Merck Index Online

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

Ceftolozane [INN] [USAN] [Wiki] [REDIRECT]
(6R,7R)-3-[(4-{[(2-Aminoethyl)carbamoyl]amino}-3-imino-2-methyl-2,3-dihydro-1H-pyrazol-1-yl)methyl]-7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-{[(2-carboxy-2-propanyl)oxy]imino}acetyl]amino}-8-oxo-5 -thia-1-azabicyclo[4.2.0]oct-2-en-2-carbonsäure [German] [ACD/IUPAC Name]
(6R,7R)-3-[(4-{[(2-Aminoethyl)carbamoyl]amino}-3-imino-2-methyl-2,3-dihydro-1H-pyrazol-1-yl)methyl]-7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-{[(2-carboxy-2-propanyl)oxy]imino}acetyl]amino}-8-oxo-5 -thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid [ACD/IUPAC Name]
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[4-[[[(2-aminoethyl)amino]carbonyl]amino]-2,3-dihydro-3-imino-2-methyl-1H-pyrazol-1-yl]methyl]-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-[( 1-carboxy-1-methylethoxy)imino]-1-oxoethyl]amino]-8-oxo-, (6R,7R)- [ACD/Index Name]
Acide (6R,7R)-3-[(4-{[(2-aminoéthyl)carbamoyl]amino}-3-imino-2-méthyl-2,3-dihydro-1H-pyrazol-1-yl)méthyl]-7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-{[(2-carboxy-2-propanyl)oxy]imino}acétyl]amino}-8 -oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ène-2-carboxylique [French] [ACD/IUPAC Name]
689293-68-3 [RN]

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: 1.830
Molar Refractivity: 157.2±0.5 cm3
#H bond acceptors: 20
#H bond donors: 10
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -2.36
ACD/LogD (pH 5.5): -4.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 348 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 94.4±7.0 dyne/cm
Molar Volume: 357.9±7.0 cm3

Click to predict properties on the Chemicalize site


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